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| "(Cl": 103, | |
| "(F)": 104, | |
| "c1ccccc1": 105, | |
| "ccccc": 106, | |
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| "C(=O)N": 108, | |
| "2+]": 109, | |
| "[NH2+]": 110, | |
| "c2ccccc": 111, | |
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| "c(C)": 141, | |
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| "o1": 246, | |
| "cs": 247, | |
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| "CCC2": 249, | |
| "(C(C)": 250, | |
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| "C(=O)N1": 255, | |
| "(N)": 256, | |
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| "c12": 276, | |
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| "[Si": 279, | |
| "(CC(=O)N": 280, | |
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| "CNC(=O)": 283, | |
| "[NH+]1": 284, | |
| "CC=": 285, | |
| ")cc(": 286, | |
| "CC(C)C": 287, | |
| "OC1": 288, | |
| "n(": 289, | |
| "c2cccc(": 290, | |
| "[Si]": 291, | |
| "[NH+]2": 292, | |
| "OC2": 293, | |
| "CC1)": 294, | |
| "c4ccccc4": 295, | |
| "CCn1": 296, | |
| "cccc": 297, | |
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| "c(C)c1": 299, | |
| "(C)cc": 300, | |
| "N#": 301, | |
| ")cc2)": 302, | |
| "CCNC(=O)": 303, | |
| "c1c(": 304, | |
| "CC2)cc1": 305, | |
| "CCS": 306, | |
| "3)n": 307, | |
| "OC(C": 308, | |
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| "c2)cc1": 311, | |
| "n(C)": 312, | |
| "5)": 313, | |
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| "NC(=O)C(": 315, | |
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| "c[nH]": 317, | |
| "NC(": 318, | |
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| "#N": 323, | |
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| "Cc1ccc(C": 328, | |
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| "C(C)C)": 330, | |
| "c6": 331, | |
| "O=C1": 332, | |
| "nc(N": 333, | |
| "C[NH+]1": 334, | |
| ")cc3": 335, | |
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| "c(C(=O)": 337, | |
| "C2)": 338, | |
| "CC2)c1": 339, | |
| "c1cccc2": 340, | |
| "Br)cc1": 341, | |
| "N(": 342, | |
| "cc(C": 343, | |
| "C1CC1": 344, | |
| "S(C)(=O)": 345, | |
| "nc(C": 346, | |
| "CCC(=O)": 347, | |
| "ccc(": 348, | |
| "CCC(=O)N": 349, | |
| "[O-])cc1": 350, | |
| "c(NC(=O)": 351, | |
| "C(N)": 352, | |
| "CN(": 353, | |
| "CCN1": 354, | |
| "c1ccc(N": 355, | |
| "c3c(": 356, | |
| "C4": 357, | |
| "[O-])c1": 358, | |
| "OC(": 359, | |
| "c1ccc(C)": 360, | |
| "(C(=O)N2": 361, | |
| ")cc2)cc1": 362, | |
| "[nH]1": 363, | |
| "c(Cl)cc": 364, | |
| "OCCO": 365, | |
| "C1=O": 366, | |
| "Cc1cccc(": 367, | |
| "=C2": 368, | |
| "n(C": 369, | |
| "CCC[NH+]": 370, | |
| "CCCC(": 371, | |
| "=S)": 372, | |
| "O1": 373, | |
| "nn1": 374, | |
| "CCC3": 375, | |
| "Br)c1": 376, | |
| "NC(=O)C1": 377, | |
| "[Si](C)": 378, | |
| "(CC(=O)": 379, | |
| "cc3": 380, | |
| "OCO": 381, | |
| ")C1": 382, | |
| "c4ccc(": 383, | |
| "N1C(=O)": 384, | |
| "n2)": 385, | |
| "c2)c1": 386, | |
| "C(C)(C)C": 387, | |
| "nc3": 388, | |
| "OCC(=O)N": 389, | |
| "c2ccc3c(": 390, | |
| "c4)": 391, | |
| "=S)N": 392, | |
| "Nc1n": 393, | |
| "Cc1cn": 394, | |
| "c5ccccc": 395, | |
| "NC(=O)C2": 396, | |
| "(N)=O)": 397, | |
| "CCS(=O)": 398, | |
| "F)cc2": 399, | |
| "P(=O)": 400, | |
| "ccccc2": 401, | |
| "(Cl)c1": 402, | |
| "O)cc1": 403, | |
| "c1ccc(C2": 404, | |
| "CCc1n": 405, | |
| "C(C)(C)": 406, | |
| "c(Cl)c1": 407, | |
| "c2ccc(N": 408, | |
| "C(N": 409, | |
| "ncn": 410, | |
| "(C2": 411, | |
| "c(S": 412, | |
| "c3cc(": 413, | |
| "(CCC": 414, | |
| "C#": 415, | |
| "c(F)c1": 416, | |
| "c2s": 417, | |
| "3)C2": 418, | |
| "CS(=O)": 419, | |
| "CCOCC1": 420, | |
| "CC1(C)": 421, | |
| "OCC)": 422, | |
| "CN(C(=O)": 423, | |
| "c(O)": 424, | |
| "ncc1": 425, | |
| "ccc1": 426, | |
| "COc1cc(": 427, | |
| "3CCCC": 428, | |
| "Cc1cc(C)": 429, | |
| "N2C(=O)": 430, | |
| "CC(CC": 431, | |
| "CC[NH+]1": 432, | |
| "c1=O": 433, | |
| "N=": 434, | |
| "C3)": 435, | |
| "cs1": 436, | |
| "n3)": 437, | |
| "c3ccc4": 438, | |
| "I)": 439, | |
| "c2cc3": 440, | |
| "CC(C)C)": 441, | |
| "CC4": 442, | |
| "C)cc1": 443, | |
| "c2nc(": 444, | |
| "s2)": 445, | |
| "C(F)(F)F": 446, | |
| "C=C": 447, | |
| "C(=O)NC(": 448, | |
| "c(C2": 449, | |
| "c2)CC1": 450, | |
| "c1ncc": 451, | |
| "(C)C1": 452, | |
| "(CO)": 453, | |
| "CC(=O)N1": 454, | |
| "(C)c1": 455, | |
| "CCC(O)": 456, | |
| "c4cc": 457, | |
| "C(=O)N2": 458, | |
| "sc1": 459, | |
| "([NH3+])": 460, | |
| "COC1": 461, | |
| "[O-])C1": 462, | |
| "OC)cc1": 463, | |
| "c1ccc(O": 464, | |
| "C(=O)N(": 465, | |
| "COc1ccc": 466, | |
| "(=O)N2": 467, | |
| "Cc1cccc": 468, | |
| "(C)C)cc1": 469, | |
| "n1)": 470, | |
| "3)cc1": 471, | |
| "=C(N": 472, | |
| "l)": 473, | |
| "CCC=": 474, | |
| "(F)c1": 475, | |
| "c(C)cc": 476, | |
| "c2ncc": 477, | |
| "(Cl)cc2": 478, | |
| "(C#N)": 479, | |
| "OC3": 480, | |
| "n2)cc1": 481, | |
| "ccc21": 482, | |
| "c1s": 483, | |
| "(C)C(C)": 484, | |
| "(C(=O)NC": 485, | |
| "CN(C)": 486, | |
| "[NH2+]C": 487, | |
| "OC)c1": 488, | |
| "C(C#N)": 489, | |
| "c1nc(": 490, | |
| "CC4)": 491, | |
| "COc1cc": 492, | |
| "(N": 493, | |
| "CCCCC2": 494, | |
| "C1=": 495, | |
| "F)cc2)": 496, | |
| "C1)": 497, | |
| "s1)": 498, | |
| "nc(C)": 499, | |
| "ccccc3": 500, | |
| "=O)c1": 501, | |
| "COC": 502, | |
| "o2)": 503, | |
| "COc1cc(C": 504, | |
| "c2cc(Cl)": 505, | |
| "CCOCCO": 506, | |
| "CCCCO": 507, | |
| "c3cccc(": 508, | |
| "CCN(CC)": 509, | |
| "c2ccc(OC": 510, | |
| "c(C(C)": 511, | |
| "N(C": 512, | |
| "N(C)": 513, | |
| "F)ccc1": 514, | |
| "C(CO)": 515, | |
| "N(C(=O)": 516, | |
| "[NH2+]C1": 517, | |
| "c7": 518, | |
| "OC(C)=O)": 519, | |
| "c3cn": 520, | |
| "n4": 521, | |
| "CCN(C": 522, | |
| "CN(C": 523, | |
| "(CCO)": 524, | |
| "SC": 525, | |
| "c5ccccc5": 526, | |
| "=C1": 527, | |
| "c1cs": 528, | |
| "c1ccc(F)": 529, | |
| "oc(": 530, | |
| "(C)C2": 531, | |
| "C(C(=O)": 532, | |
| "c(N2": 533, | |
| "CCOCC2)": 534, | |
| "CCc1ccc(": 535, | |
| "(CCCC": 536, | |
| "c2cc(C": 537, | |
| "c2ccc(Br": 538, | |
| "c3ccc(C": 539, | |
| "[nH]c(": 540, | |
| "3)CC2)": 541, | |
| "NC(=O)C": 542, | |
| "OCCC": 543, | |
| "(c2ccccc": 544, | |
| "no1": 545, | |
| "(=O)N1": 546, | |
| "c(OC)c1": 547, | |
| "c2cc(C)": 548, | |
| "ccc4": 549, | |
| "C(O)C(O)": 550, | |
| "CCOC1": 551, | |
| "OCC1": 552, | |
| "c2ccc(C)": 553, | |
| "c1cc2c(": 554, | |
| "c2cccc3": 555, | |
| "O)cc": 556, | |
| "o1)": 557, | |
| "=O)cc": 558, | |
| "c[nH+]": 559, | |
| "CCOC": 560, | |
| "O=S(=O)": 561, | |
| "CCCC(C)": 562, | |
| "N=C": 563, | |
| "CCCn1": 564, | |
| "3CCO": 565, | |
| "c4cccc": 566, | |
| "c2C)": 567, | |
| "c2ncn": 568, | |
| "C(=": 569, | |
| "c(Br)": 570, | |
| "CCC4": 571, | |
| "c2cs": 572, | |
| "c2cccc(C": 573, | |
| "c(O": 574, | |
| "[n+]": 575, | |
| "CCCCC2)": 576, | |
| "(C)C)c1": 577, | |
| "C1CCCCC1": 578, | |
| "F)cc3)": 579, | |
| ")C(=O)N": 580, | |
| "Cc1cc(C": 581, | |
| "(Cl)ccc1": 582, | |
| "CCCC2)": 583, | |
| "c1nnc(": 584, | |
| "c12)": 585, | |
| "nc2)": 586, | |
| "C(=C": 587, | |
| "c1c(C)": 588, | |
| "(Cl)cc2)": 589, | |
| "ccccc6": 590, | |
| "C12": 591, | |
| "%1": 592, | |
| "C(NC(=O)": 593, | |
| "OC(CO)": 594, | |
| "(CC2": 595, | |
| "c2cc(F)": 596, | |
| "c1ccc(N2": 597, | |
| "o2)cc1": 598, | |
| "c1cccs1": 599, | |
| "[O-])cc": 600, | |
| "C2=O)": 601, | |
| "c1cccnc1": 602, | |
| "=C(N)": 603, | |
| "C=C1": 604, | |
| "c1cc(N": 605, | |
| "3CCCCC": 606, | |
| "CCC)": 607, | |
| "C(=S)N": 608, | |
| "c(C#N)": 609, | |
| "c21": 610, | |
| "[N-]": 611, | |
| "CCO)": 612, | |
| "n2cc": 613, | |
| "c(S(=O)": 614, | |
| "CCCN(": 615, | |
| "C(C(=O)N": 616, | |
| "c1ncn": 617, | |
| "n1C": 618, | |
| "c2ccc(F)": 619, | |
| "C[NH+]2": 620, | |
| "NC(=O)CS": 621, | |
| "c2nnc(": 622, | |
| "(O": 623, | |
| "n2cn": 624, | |
| "(C(C)C)": 625, | |
| "c3ccccc2": 626, | |
| "n2)c1": 627, | |
| "[NH2+]C2": 628, | |
| "Cc1cc2": 629, | |
| "N)=O)": 630, | |
| "s3)": 631, | |
| "OC(=O)N": 632, | |
| "C1CCC": 633, | |
| "F)cc3": 634, | |
| "CCCCC1)": 635, | |
| "Oc1ccc(": 636, | |
| "(C)C)cc": 637, | |
| "NC(C)": 638, | |
| "CN1C(=O)": 639, | |
| "=[NH2+]": 640, | |
| "C1O": 641, | |
| "c(OC": 642, | |
| "c6ccccc6": 643, | |
| "S1": 644, | |
| "CC1(": 645, | |
| "SCC(=O)N": 646, | |
| "c1[nH]": 647, | |
| "c2)C1": 648, | |
| "c2c(C)": 649, | |
| "=CC(=O)": 650, | |
| "c3ccc4c(": 651, | |
| "OC(F)(F)": 652, | |
| "(N)(=O)": 653, | |
| "CCC(CC)": 654, | |
| "c1c[nH]": 655, | |
| "co": 656, | |
| "CC(C(=O)": 657, | |
| "CO)": 658, | |
| "no": 659, | |
| "CCN(CC": 660, | |
| "s2)cc1": 661, | |
| "OCCCC": 662, | |
| "C(=O)OC": 663, | |
| "c2n1": 664, | |
| "C2)cc1": 665, | |
| "F)c1": 666, | |
| "nc12": 667, | |
| "Br)cc": 668, | |
| "NC1": 669, | |
| "CCNC(N": 670, | |
| "3)CC1": 671, | |
| "c2)n1": 672, | |
| "c2[nH]": 673, | |
| "C=C(": 674, | |
| "3CCOCC3)": 675, | |
| "=C(O)": 676, | |
| "ncc2": 677, | |
| "C#N)": 678, | |
| "c1ccncc1": 679, | |
| "c(Br)c1": 680, | |
| "CCCCCC1": 681, | |
| ")cc21": 682, | |
| "-2": 683, | |
| "C2)c1": 684, | |
| "Cc1cs": 685, | |
| "N3": 686, | |
| "O=[N+]": 687, | |
| "Br)ccc1": 688, | |
| "c2=O)": 689, | |
| "Cc1ccc2": 690, | |
| "Cc2ccc": 691, | |
| "NC(=O)CO": 692, | |
| "C1CCCC1": 693, | |
| "3)c1": 694, | |
| "c(F)c(F)": 695, | |
| "C[NH+](C": 696, | |
| "C)c1": 697, | |
| "c1cc(C)": 698, | |
| "C#N": 699, | |
| "NC(=S)N": 700, | |
| "F)cc1)": 701, | |
| "nnc1": 702, | |
| "CC(C)O": 703, | |
| "c5ccc": 704, | |
| "O)c1": 705, | |
| ")cc2)c1": 706, | |
| "S(N)(=O)": 707, | |
| "CC2)CC1": 708, | |
| "C5": 709, | |
| "CC#": 710, | |
| "4)CC3)": 711, | |
| "O[Si](C)": 712, | |
| "CCCC(C": 713, | |
| "CCN2": 714, | |
| "CC12": 715, | |
| "c1c(F)cc": 716, | |
| "nn2": 717, | |
| "COc1ccc2": 718, | |
| "CC(N": 719, | |
| "c2nc(C": 720, | |
| "O=C(NC1": 721, | |
| "C=C(C)": 722, | |
| "cc(N": 723, | |
| "n(CC": 724, | |
| "3CC3)": 725, | |
| "n2)CC1": 726, | |
| "oc(C": 727, | |
| "nc3)": 728, | |
| "c4c(": 729, | |
| "CC1CCC": 730, | |
| "(Cl)cc3": 731, | |
| "Cl)cc1": 732, | |
| "c2cc(Br)": 733, | |
| "OC(F)": 734, | |
| "c2ccncc": 735, | |
| "n[nH]": 736, | |
| "OCC2": 737, | |
| "(Cl)cc3)": 738, | |
| "Cc1nc(": 739, | |
| "CN2": 740, | |
| "nc(N)": 741, | |
| "C2=O)cc1": 742, | |
| "nc2c1": 743, | |
| "CCCC(=O)": 744, | |
| "(F)F)": 745, | |
| "Cc2ccccc": 746, | |
| "(C)CC1": 747, | |
| "c3s": 748, | |
| "NC(=O)N2": 749, | |
| "CCCC1)": 750, | |
| "OP(=O)": 751, | |
| "Nc1ccc(": 752, | |
| "C(N)=O": 753, | |
| ")cc2)CC1": 754, | |
| "6)": 755, | |
| "CC2)n1": 756, | |
| "ncn1": 757, | |
| "CCCS": 758, | |
| "OCC(=O)": 759, | |
| "2)C1=O": 760, | |
| "CC2)ccc1": 761, | |
| ")cc4": 762, | |
| ")cccc1": 763, | |
| "C(=O)N(C": 764, | |
| "sc2c1": 765, | |
| "C(=O)C1": 766, | |
| "o3)": 767, | |
| "c1cc(Cl)": 768, | |
| "OC)c(OC)": 769, | |
| "Cc1ccc(N": 770, | |
| "c3ccc(OC": 771, | |
| "c2cc1": 772, | |
| "CC1=": 773, | |
| "C(CC)": 774, | |
| "CC=C": 775, | |
| "c2c(F)cc": 776, | |
| "C(OC": 777, | |
| "c1)OCO": 778, | |
| "c3ncc": 779, | |
| "N(CC": 780, | |
| "c1nc(N": 781, | |
| "c(=O)n2": 782, | |
| "c3ccc(N": 783, | |
| "c8": 784, | |
| "c3C)": 785, | |
| "CC1(C": 786, | |
| "CC1C": 787, | |
| "c1)C(=O)": 788, | |
| "cc4": 789, | |
| "CN(CC": 790, | |
| "ccc2c1": 791, | |
| "ccccc4": 792, | |
| "c4ccc5": 793, | |
| "C(=O)NC1": 794, | |
| "(C)C3": 795, | |
| "CC(=": 796, | |
| "CC(F)(F)": 797, | |
| "cc(Br)": 798, | |
| "(C(=O)C2": 799, | |
| "CC[NH+]2": 800, | |
| "CC(O": 801, | |
| "C(C)O": 802, | |
| "3)C1": 803, | |
| "CCC(CC": 804, | |
| "[O-])CC1": 805, | |
| "CCC=CCC=": 806, | |
| "[NH3+]C1": 807, | |
| "c(=O)n1": 808, | |
| "cn2": 809, | |
| "[NH+]3": 810, | |
| "[NH2+]1": 811, | |
| "CCC2)": 812, | |
| "(OC)": 813, | |
| "ccnc1": 814, | |
| "c5ccc(": 815, | |
| "CC2)C1": 816, | |
| "NC(=O)N1": 817, | |
| "c1N": 818, | |
| "(C(C)=O)": 819, | |
| "CCC(N": 820, | |
| "c3c2": 821, | |
| "CCl)": 822, | |
| "C(Cl)": 823, | |
| "c2cccs2)": 824, | |
| "Cc1c(": 825, | |
| "CC(C)C1": 826, | |
| "3CCCC3": 827, | |
| "C(N)=O)": 828, | |
| "[O-])cc2": 829, | |
| "nc4": 830, | |
| "(c3ccccc": 831, | |
| "[NH2+]C)": 832, | |
| "(C)C)C1": 833, | |
| "n1cn": 834, | |
| "O2": 835, | |
| "c3nn": 836, | |
| "OC(C)(C)": 837, | |
| "c1nc(C": 838, | |
| "c3cccc4": 839, | |
| "c2cccnc2": 840, | |
| ")c1ccc(": 841, | |
| "CC1(C)C": 842, | |
| "c3cc4": 843, | |
| "nc1)": 844, | |
| "COc1cccc": 845, | |
| "NC2": 846, | |
| "Cc1s": 847, | |
| "CCCC3": 848, | |
| "CC(=O)N2": 849, | |
| "=NNC(=O)": 850, | |
| "=C(C)": 851, | |
| "[NH+](C)": 852, | |
| "CC(CC(C": 853, | |
| "=C(C": 854, | |
| "#C": 855, | |
| "F)CC1": 856, | |
| "=C(C(=O)": 857, | |
| "C(=O)C(": 858, | |
| "sc2": 859, | |
| "c1ccco1": 860, | |
| "[nH]c1": 861, | |
| "(=O)C1": 862, | |
| "[NH2+]C(": 863, | |
| "c2cc3c(": 864, | |
| "=C([O-])": 865, | |
| "c3cc(Cl)": 866, | |
| "c1ccccn1": 867, | |
| "oc1": 868, | |
| "(NC(=O)": 869, | |
| "CC(C)(O)": 870, | |
| "c1ncccc1": 871, | |
| "OCC(C": 872, | |
| "CCO1": 873, | |
| "3C)": 874, | |
| "Cl)c1": 875, | |
| "CCC(C)C": 876, | |
| "Sc1n": 877, | |
| "ccccc7": 878, | |
| "ccccc12": 879, | |
| "#N)cc1": 880, | |
| "Oc2ccc(": 881, | |
| "CCOC2": 882, | |
| "c3nc(": 883, | |
| "C(=O)C2": 884, | |
| "Cc1no": 885, | |
| "c5)": 886, | |
| "n2ccc": 887, | |
| "Cc1[nH]": 888, | |
| "3)n2)cc1": 889, | |
| "(Cl)c2": 890, | |
| "C1C": 891, | |
| "CC(CO)": 892, | |
| "OCC(O)": 893, | |
| "=C(C#N)": 894, | |
| "CCCO1": 895, | |
| ")cc4)": 896, | |
| "n12": 897, | |
| "[nH]c2c1": 898, | |
| "cccc1": 899, | |
| "CCCN1": 900, | |
| "c1c(C": 901, | |
| "Cc1nn(C)": 902, | |
| "c3cc(C)": 903, | |
| "NC": 904, | |
| "2)nc1": 905, | |
| "C3=O)": 906, | |
| "OC(C)C)": 907, | |
| "CCOCC1)": 908, | |
| "OC(C)C": 909, | |
| "(Cl)c2)": 910, | |
| "4CCCC": 911, | |
| "c2c[nH]": 912, | |
| "C=CC(=O)": 913, | |
| "OC(=O)N1": 914, | |
| "C1CCN": 915, | |
| "S)": 916, | |
| "c2nc(N": 917, | |
| "[NH2+]CC": 918, | |
| "C=N": 919, | |
| "c%1": 920, | |
| "CCN(C)": 921, | |
| "=[NH2+])": 922, | |
| "c(C)n1": 923, | |
| "C(=[NH+]": 924, | |
| "n[nH]1": 925, | |
| "(Cl)cc1)": 926, | |
| "=CC=": 927, | |
| "c2)OCO": 928, | |
| "cc21": 929, | |
| "c1cc(Br)": 930, | |
| "F)cc1F": 931, | |
| "c1cc(F)": 932, | |
| "CCCC)": 933, | |
| "(F)c2)": 934, | |
| "CCC(O": 935, | |
| "C(=O)O": 936, | |
| ")N(C": 937, | |
| "(C(=O)C": 938, | |
| "=C2S": 939, | |
| "=C)": 940, | |
| "NC(=O)CC": 941, | |
| "NC(=O)C3": 942, | |
| "c(Cl)c2)": 943, | |
| "s2)c1": 944, | |
| "C=CC=": 945, | |
| "CCNS(=O)": 946, | |
| "CC(N)=O)": 947, | |
| "c(Cl)c3)": 948, | |
| "OC)c1OC": 949, | |
| "(C)(C)": 950, | |
| "OCCO2": 951, | |
| "FC(F)(F)": 952, | |
| "c4cc(": 953, | |
| "3CCCC3)": 954, | |
| "Cl)CC1": 955, | |
| "ccccc2c1": 956, | |
| "ccc(C": 957, | |
| "cn2)": 958, | |
| "COCCO": 959, | |
| "CC1(O)": 960, | |
| "nc(N2": 961, | |
| "[nH]1)": 962, | |
| "CC(C)C(": 963, | |
| "o2)c1": 964, | |
| "F)C1": 965, | |
| "c7ccccc7": 966, | |
| "cc(C)": 967, | |
| "F)cc(": 968, | |
| "c3c(C)": 969, | |
| "[nH]2)": 970, | |
| "(Cl)c3)": 971, | |
| "c2ccco2)": 972, | |
| "SC1": 973, | |
| "n2c(": 974, | |
| "C2=O": 975, | |
| "nn3": 976, | |
| "on1": 977, | |
| "[nH]c2": 978, | |
| "CC5": 979, | |
| "4)c3)": 980, | |
| "C)CC1": 981, | |
| "C2CCCC": 982, | |
| "c3ccc(Br": 983, | |
| "=C2C(=O)": 984, | |
| "3CCCCC3)": 985, | |
| "c2ccc(O": 986, | |
| "2)ccc1": 987, | |
| "(C(=O)N3": 988, | |
| "c3ccncc": 989, | |
| "CC1CCCC": 990, | |
| "n2c(=O)": 991, | |
| "N)c1": 992, | |
| ")NC1": 993, | |
| "CNS(=O)": 994, | |
| "C2CC2)": 995, | |
| "Cn1cn": 996, | |
| "CC(C)(C": 997, | |
| "Cc1cccc2": 998, | |
| "(C)C)CC1": 999, | |
| "cccc(": 1000, | |
| "cnc1": 1001, | |
| "[C": 1002, | |
| "4CCO": 1003, | |
| "nc2cccc": 1004, | |
| "[nH]c1=O": 1005, | |
| "CCc1cc": 1006, | |
| "C=C(C": 1007, | |
| "c1)C1": 1008, | |
| "F)cc(C": 1009, | |
| "CCc1": 1010, | |
| "c(C)c(C)": 1011, | |
| "C2)n1": 1012, | |
| "CCCS(=O)": 1013, | |
| "OC)c(": 1014, | |
| "N=C(": 1015, | |
| "(C)(C)C)": 1016, | |
| "(C)O": 1017, | |
| "=CC(=O)N": 1018, | |
| "CCC12": 1019, | |
| "c1cccc(N": 1020, | |
| "Cc1nc(C": 1021, | |
| "=C3": 1022, | |
| "4)c3": 1023, | |
| "c2cc(N": 1024, | |
| "C3CC3)": 1025, | |
| "NC(=S)": 1026, | |
| "C=CC1": 1027, | |
| "CCCO)": 1028, | |
| "CCCCCC": 1029, | |
| "Cc1cc(N": 1030, | |
| "c2ccs": 1031, | |
| "CC(C)CC(": 1032, | |
| "SC)": 1033, | |
| "C(C)=O)": 1034, | |
| "=[N+]": 1035, | |
| "[NH+](C": 1036, | |
| "COCC1": 1037, | |
| "3)c2": 1038, | |
| "c2c(C)cc": 1039, | |
| "s2)CC1": 1040, | |
| "CCl": 1041, | |
| "CCC2(": 1042, | |
| ")(": 1043, | |
| "c2nn": 1044, | |
| "Cc2ccc(": 1045, | |
| "=C(N)N)": 1046, | |
| "2)C(=O)": 1047, | |
| "c1cc(C2": 1048, | |
| "(C(=O)OC": 1049, | |
| "cc1Cl": 1050, | |
| "COc1": 1051, | |
| "C4)": 1052, | |
| "CCC3)": 1053, | |
| ")ccn1": 1054, | |
| "c3cccc(C": 1055, | |
| "CC(=O)N(": 1056, | |
| "c1ccc(OC": 1057, | |
| "CCCc1n": 1058, | |
| "c3cccs3)": 1059, | |
| "CC(N)": 1060, | |
| "ccn1": 1061, | |
| "Br)cc(": 1062, | |
| "[O-])c(": 1063, | |
| "c2o": 1064, | |
| "C(OC(=O)": 1065, | |
| ")NC(=O)": 1066, | |
| "2)cc1OC": 1067, | |
| "C=CCO": 1068, | |
| ")ccc1OC": 1069, | |
| "c2ncccc2": 1070, | |
| "2)s1": 1071, | |
| "O=S(=O)(": 1072, | |
| "c2ccc(N3": 1073, | |
| "4)cc3": 1074, | |
| "[nH]c3": 1075, | |
| "(C)C)n1": 1076, | |
| "CSc1n": 1077, | |
| "C2CCC": 1078, | |
| "C=CC": 1079, | |
| "c3ncn": 1080, | |
| "C2)CC1": 1081, | |
| "C2O)": 1082, | |
| "c3ccc(C)": 1083, | |
| "c(=O)o": 1084, | |
| "O=C(C1": 1085, | |
| "[nH+]1": 1086, | |
| ")cc2c1": 1087, | |
| "C(OC)": 1088, | |
| "c(Cl)cc1": 1089, | |
| "[n-]": 1090, | |
| "C2)C1": 1091, | |
| "NN": 1092, | |
| "(C(=O)O": 1093, | |
| "c1cccs1)": 1094, | |
| "[P": 1095, | |
| "c1ccco1)": 1096, | |
| "OCCCO": 1097, | |
| "(F)c3)": 1098, | |
| "Cc1o": 1099, | |
| "CC(C)n1": 1100, | |
| "C=CCn1": 1101, | |
| "cc1C": 1102, | |
| "c4n": 1103, | |
| "CC1CC1": 1104, | |
| "c2nnc(C": 1105, | |
| "c(N)c1": 1106, | |
| "CCCCCCC": 1107, | |
| ")N1CCN(": 1108, | |
| "c(N3": 1109, | |
| "c(O)c1": 1110, | |
| "c3cc(F)": 1111, | |
| "(C)CC": 1112, | |
| "C)C1": 1113, | |
| "2)cc1)": 1114, | |
| ")cc(C": 1115, | |
| "C3CCCCC": 1116, | |
| "c3ccc(F)": 1117, | |
| "c(=O)c1": 1118, | |
| "c1)OCO2": 1119, | |
| "c4cn": 1120, | |
| "c2ccc(O)": 1121, | |
| "n2)C1": 1122, | |
| "cc(Cl)": 1123, | |
| "c(F)c2)": 1124, | |
| "C1(": 1125, | |
| "OS(=O)": 1126, | |
| "NC(C)=O)": 1127, | |
| "C(CC(=O)": 1128, | |
| "Cn1cc(": 1129, | |
| "(C)cc2)": 1130, | |
| "S1(=O)": 1131, | |
| "c2ccc(CC": 1132, | |
| "(CC)CC": 1133, | |
| "2)c1C": 1134, | |
| "c1ncc(": 1135, | |
| "(C)cc3)": 1136, | |
| "CC(=O)O": 1137, | |
| "(F)c2": 1138, | |
| "4)ccc3": 1139, | |
| "ccc5": 1140, | |
| "c1ccc(CN": 1141, | |
| "c(=O)c2": 1142, | |
| "c1cncc(": 1143, | |
| "c2nc(C)": 1144, | |
| "[P+]": 1145, | |
| "c3[nH]": 1146, | |
| "[n+]1": 1147, | |
| "CCOc1ccc": 1148, | |
| "C[NH3+]": 1149, | |
| "4CCCCC": 1150, | |
| "4)cc3)": 1151, | |
| "C(=O)NC": 1152, | |
| "ncc(": 1153, | |
| "3)C1)": 1154, | |
| "CC(F)": 1155, | |
| "C(C)C1": 1156, | |
| "Nc1cc": 1157, | |
| "[O-])c2)": 1158, | |
| "C1=O)": 1159, | |
| "(C)C(": 1160, | |
| "O2)": 1161, | |
| "=NN": 1162, | |
| "CCCC3)": 1163, | |
| "c2c(C": 1164, | |
| "c2nccc": 1165, | |
| "nc(C2": 1166, | |
| "C1(C": 1167, | |
| "c(NC": 1168, | |
| "nc2n1": 1169, | |
| "c2sccc2": 1170, | |
| "n5": 1171, | |
| "=[N-]": 1172, | |
| "[S-]": 1173, | |
| "CCOC(C": 1174, | |
| "COP(=O)": 1175, | |
| "c1ccc(n2": 1176, | |
| "(Br)": 1177, | |
| "c3cc(C": 1178, | |
| "c1o": 1179, | |
| "=[NH+]O)": 1180, | |
| "CC1CCN": 1181, | |
| "CC2CCC1": 1182, | |
| ")ccc1Cl": 1183, | |
| "C(=O)NC2": 1184, | |
| "I)c1": 1185, | |
| "c3ccco3)": 1186, | |
| "nnn1": 1187, | |
| "CCC(CO)": 1188, | |
| "n2c1": 1189, | |
| "nc21": 1190, | |
| "n3cn": 1191, | |
| "cnn1": 1192, | |
| "n(C2": 1193, | |
| "c4ccc(C": 1194, | |
| ")S(=O)": 1195, | |
| "cc12": 1196, | |
| "Nc1cc(": 1197, | |
| "I)cc1": 1198, | |
| "nc1C": 1199, | |
| "NC(N)": 1200, | |
| "cnc2": 1201, | |
| "(CCC(=O)": 1202, | |
| "n4)": 1203, | |
| "c2cc(OC)": 1204, | |
| "2)cn1": 1205, | |
| "CCc1cccc": 1206, | |
| "Cn1c(=O)": 1207, | |
| ")cc2)n1": 1208, | |
| "C1C2": 1209, | |
| "(CC)CC)": 1210, | |
| "(CC(C)C)": 1211, | |
| "C1CCN(": 1212, | |
| "C(=N": 1213, | |
| "P(": 1214, | |
| "O=C(CO": 1215, | |
| "(F)c1)": 1216, | |
| "c2ncc(": 1217, | |
| "C=C(C)C": 1218, | |
| "NC(=O)CN": 1219, | |
| "CCc1cn": 1220, | |
| "n2)n1": 1221, | |
| "c([O-])": 1222, | |
| "CC1O": 1223, | |
| "(C)cc(C)": 1224, | |
| "C(=O)OCC": 1225, | |
| "(C)ccc1": 1226, | |
| "Cc1c(C": 1227, | |
| "SC2": 1228, | |
| ")ccc1F": 1229, | |
| "cn2)cc1": 1230, | |
| "c1nc2c(": 1231, | |
| "COc1cc2": 1232, | |
| "CC21": 1233, | |
| "CCc1ccc": 1234, | |
| "C(F)F": 1235, | |
| "CC1CN(": 1236, | |
| "c2nnn": 1237, | |
| "(Cl)c1)": 1238, | |
| "c4cccc(": 1239, | |
| "CCOC(": 1240, | |
| "c(F)c1F": 1241, | |
| "Cl)C1": 1242, | |
| "c2C)cc1": 1243, | |
| "(Cl)c(": 1244, | |
| "CCCC(O)": 1245, | |
| "OC4": 1246, | |
| "c1csc(": 1247, | |
| "CC5)": 1248, | |
| "4CCOCC4)": 1249, | |
| "CC(Cl)": 1250, | |
| "C(O)C1": 1251, | |
| "3)cc2": 1252, | |
| "CCCCn1": 1253, | |
| "C(CS": 1254, | |
| "OC)C1": 1255, | |
| "OC(C)=O": 1256, | |
| "CC=C(": 1257, | |
| "NC(=O)OC": 1258, | |
| "CC[NH+](": 1259, | |
| "c4ccccc3": 1260, | |
| "3CC4": 1261, | |
| "C=O": 1262, | |
| "C1=C(C)": 1263, | |
| "F)cc2)c1": 1264, | |
| "CC[NH3+]": 1265, | |
| "CCc1cc(": 1266, | |
| "c9": 1267, | |
| "O)cc2)": 1268, | |
| ")cc2)C1": 1269, | |
| "c1ccsc1": 1270, | |
| "nccc1": 1271, | |
| "O[Si]": 1272, | |
| "c1nc(C)": 1273, | |
| "=[NH+]C": 1274, | |
| "c2ccc(C3": 1275, | |
| "CCCC2)c1": 1276, | |
| "c1)N": 1277, | |
| "CCCCN": 1278, | |
| "(=O)C": 1279, | |
| "nc(Cl)": 1280, | |
| "-3": 1281, | |
| "c1c(C)cc": 1282, | |
| "Cc1cc2c(": 1283, | |
| "C(OC2": 1284, | |
| "c4ccc5c(": 1285, | |
| "2)c(C)c1": 1286, | |
| "[O-])cc(": 1287, | |
| "C(CCCC": 1288, | |
| "CC1CC1)": 1289, | |
| "cc(C(=O)": 1290, | |
| "cc2c1": 1291, | |
| "CC1CO": 1292, | |
| "CC2)c1C": 1293, | |
| "N)cc1": 1294, | |
| ")ccc1O": 1295, | |
| "C)n1": 1296, | |
| "O=C(CS": 1297, | |
| "(C)O)": 1298, | |
| "(Cl)c(C": 1299, | |
| "c1c(N": 1300, | |
| "3)c2)": 1301, | |
| "C1CCCC": 1302, | |
| "(OCC)": 1303, | |
| "CC1CCN(": 1304, | |
| "c(=S)": 1305, | |
| "c(C3": 1306, | |
| "c2noc(C": 1307, | |
| "F)cc4)": 1308, | |
| "C(C(C)C)": 1309, | |
| "(CCC)": 1310, | |
| "OC)cc(": 1311, | |
| "O)cc1)": 1312, | |
| "cn1)": 1313, | |
| "c2n[nH]": 1314, | |
| "(C)CCC": 1315, | |
| "1)N": 1316, | |
| "c(Cl)c1)": 1317, | |
| "[O-])n1": 1318, | |
| "C(C)=O": 1319, | |
| "c(=O)n(": 1320, | |
| "O=C(Cn1": 1321, | |
| "OC)cc": 1322, | |
| "2)o1": 1323, | |
| "cc2Cl)": 1324, | |
| "c3cccnc3": 1325, | |
| "C(CC": 1326, | |
| "c(F)c3)": 1327, | |
| "CCc2c(": 1328, | |
| "CC(C)=": 1329, | |
| "c2nc3c(": 1330, | |
| "n3cc": 1331, | |
| "cn3": 1332, | |
| "Oc2ccc": 1333, | |
| "o2)CC1": 1334, | |
| "2)c(": 1335, | |
| "c(SC": 1336, | |
| "3)CC2": 1337, | |
| "C6": 1338, | |
| "=O)C1": 1339, | |
| "ccc3C)": 1340, | |
| "Cc1nn(": 1341, | |
| "nc(S": 1342, | |
| "O=c1": 1343, | |
| "=O)N": 1344, | |
| "sc3": 1345, | |
| "CCCOC1": 1346, | |
| "nn1C": 1347, | |
| "CCC(C)C(": 1348, | |
| "n(C)c1": 1349, | |
| "O=C1N": 1350, | |
| "c1ccc(S": 1351, | |
| "ncnc1": 1352, | |
| "2)N1": 1353, | |
| "F)n1": 1354, | |
| "CC=CC=": 1355, | |
| "c[nH]1)": 1356, | |
| "CCC3(CC": 1357, | |
| "(N)=S)": 1358, | |
| "[NH3+])N": 1359, | |
| "e]": 1360, | |
| "(=O)[nH]": 1361, | |
| "c1nn": 1362, | |
| "ncc3": 1363, | |
| "(Cc2ccc": 1364, | |
| "OCC3": 1365, | |
| "sc(": 1366, | |
| "CCC1)": 1367, | |
| "7)": 1368, | |
| "cccc3": 1369, | |
| "c5ccc6": 1370, | |
| "CCCN2": 1371, | |
| "3)ccc2": 1372, | |
| "c2=O)cc1": 1373, | |
| "C=CC(": 1374, | |
| "(C)C(C": 1375, | |
| "n2cc(": 1376, | |
| "2)C2": 1377, | |
| "n2nn": 1378, | |
| "C=CCN": 1379, | |
| ")N1CCC(": 1380, | |
| "cccn1": 1381, | |
| "CC1CC(": 1382, | |
| "3CCCCC3": 1383, | |
| "C[Si](C)": 1384, | |
| "Cn1cc(C": 1385, | |
| "n2n": 1386, | |
| "nnc2": 1387, | |
| "3)C2)cc1": 1388, | |
| "nc1N": 1389, | |
| "CC1CCC(": 1390, | |
| "(C(=O)N1": 1391, | |
| "B(O)": 1392, | |
| "COC(=O)N": 1393, | |
| "CC3)cc2": 1394, | |
| "N=N": 1395, | |
| "c5cccc": 1396, | |
| "c1cc(N2": 1397, | |
| "ccccc5": 1398, | |
| "(CC(O)": 1399, | |
| "4)C3": 1400, | |
| "cn2)CC1": 1401, | |
| "3CCC": 1402, | |
| "COC(": 1403, | |
| "c1c(N)": 1404, | |
| "H]": 1405, | |
| "(=O)o": 1406, | |
| "c2cncc": 1407, | |
| "c-2": 1408, | |
| "C[NH3+])": 1409, | |
| "ccccc8": 1410, | |
| "3)C2)": 1411, | |
| "CCC2C3": 1412, | |
| "(=O)[O-]": 1413, | |
| "F)cc1Cl": 1414, | |
| "CCCCCO": 1415, | |
| ")cc5": 1416, | |
| "CC1CCCC1": 1417, | |
| "COCCC": 1418, | |
| "3C(=O)": 1419, | |
| "Nc1ccc": 1420, | |
| "OCO4)": 1421, | |
| "CCCl)": 1422, | |
| "C(Cc1cn": 1423, | |
| "c3cccs": 1424, | |
| "c2sc(": 1425, | |
| "(CC(C)": 1426, | |
| "CCOCC2": 1427, | |
| "O=c1[nH]": 1428, | |
| "Oc2ccccc": 1429, | |
| "CCCN(C": 1430, | |
| "c1ccc(C(": 1431, | |
| "C(F)F)": 1432, | |
| "c1)OCCO2": 1433, | |
| "c(Cl)cc2": 1434, | |
| "sc1C": 1435, | |
| ")cc12": 1436, | |
| "c6ccc": 1437, | |
| "c2csc(": 1438, | |
| "c2cc(N)": 1439, | |
| "c4c3": 1440, | |
| "c3cs": 1441, | |
| "(CCl)": 1442, | |
| "c(C)cc1": 1443, | |
| "N#C": 1444, | |
| "C(O)C1O": 1445, | |
| "c2cnn(C)": 1446, | |
| "c2)OCCO": 1447, | |
| "c2)OCO3)": 1448, | |
| "C(C2": 1449, | |
| "F)cc4": 1450, | |
| "4CC4)": 1451, | |
| "c5cc": 1452, | |
| "c3c(c2": 1453, | |
| "Cn1cc": 1454, | |
| "CC2CCCO": 1455, | |
| "C(C)C)c1": 1456, | |
| "[C-]": 1457, | |
| "Cc1c(C)": 1458, | |
| "(=O)c1cc": 1459, | |
| "c1ccc(O)": 1460, | |
| "c2cco": 1461, | |
| "[O-])c2": 1462, | |
| ")cc1)": 1463, | |
| "CC1CCC(C": 1464, | |
| "c(C)c3)": 1465, | |
| "cc5": 1466, | |
| "(C)c2": 1467, | |
| "ccc2n1": 1468, | |
| "OC(F)F": 1469, | |
| "CCCC(C)C": 1470, | |
| "COC(C": 1471, | |
| "[O-])c3)": 1472, | |
| "[N+]1": 1473, | |
| "n2C": 1474, | |
| "Cc1cc(N2": 1475, | |
| "CNC(=O)N": 1476, | |
| "C(C)C2": 1477, | |
| "CCCO1)": 1478, | |
| "Cc1ccc(O": 1479, | |
| "CC(C)c1n": 1480, | |
| "n(C)n1": 1481, | |
| "COCCn1": 1482, | |
| "C(C)CC": 1483, | |
| "Br)cc2": 1484, | |
| "Cl)N": 1485, | |
| "c1sccc1": 1486, | |
| "(C)cc3": 1487, | |
| "CC(=N": 1488, | |
| "C2CCCCC": 1489, | |
| "c4cccc5": 1490, | |
| "C)C(=O)": 1491, | |
| "SC(=C": 1492, | |
| "(C3": 1493, | |
| "c(=O)n3": 1494, | |
| "CC(C#N)": 1495, | |
| "c(F)c2": 1496, | |
| "C1CCC(": 1497, | |
| "(C)CC2": 1498, | |
| "C=C2": 1499, | |
| "2)N": 1500, | |
| "cc1Cl)": 1501, | |
| "c1cnc(": 1502, | |
| "c1C#N": 1503, | |
| "N1CCCC1": 1504, | |
| "=O)CC1": 1505, | |
| "CC(C)(": 1506, | |
| "CCCCC=": 1507, | |
| "2)cc1C": 1508, | |
| "(c2ccc(": 1509, | |
| "(CCCC)": 1510, | |
| "C(C1": 1511, | |
| "4)C2)": 1512, | |
| "c1c(Cl)": 1513, | |
| "c(C(C)C)": 1514, | |
| "n2C)": 1515, | |
| "CCc2ccc(": 1516, | |
| "COCCN": 1517, | |
| "OCc1ccc(": 1518, | |
| "c(=O)n(C": 1519, | |
| "N(C)C": 1520, | |
| "3)C1)C2": 1521, | |
| "C(Br)": 1522, | |
| "c1nc(N)": 1523, | |
| "Br)c2)": 1524, | |
| "c(C)c(": 1525, | |
| "ccc2Cl)": 1526, | |
| "nc2s": 1527, | |
| "[nH]3)": 1528, | |
| "CSCCC(": 1529, | |
| "c8ccccc8": 1530, | |
| "CCC(C)C)": 1531, | |
| "CCCCC)": 1532, | |
| "(C)c(": 1533, | |
| "CO1": 1534, | |
| "=NC(=O)": 1535, | |
| "OC)C(=O)": 1536, | |
| "CCCCCC)": 1537, | |
| "O)C(O)": 1538, | |
| "c2c(c1)": 1539, | |
| "n2nc(": 1540, | |
| "c(F)cc2": 1541, | |
| "C2CC3": 1542, | |
| "3)n2)": 1543, | |
| "#[N+]": 1544, | |
| "c(C)c1C": 1545, | |
| "Cc1ccsc1": 1546, | |
| "O1)": 1547, | |
| "C2CCCCC2": 1548, | |
| "s2)C1": 1549, | |
| "F)cccc3": 1550, | |
| "c(=O)n": 1551, | |
| "C1CC": 1552, | |
| "[NH3+]C(": 1553, | |
| "C2=O)c1": 1554, | |
| "(Cl)s1": 1555, | |
| "[n+]2": 1556, | |
| "[O-])cc3": 1557, | |
| "CC(S": 1558, | |
| "Cc1ccco1": 1559, | |
| ")N1CCCC1": 1560, | |
| "cc2C)": 1561, | |
| "C(C)O)": 1562, | |
| "C1(C)": 1563, | |
| "(CNC(=O)": 1564, | |
| "C1CC1)": 1565, | |
| "O3)": 1566, | |
| "COc1c(": 1567, | |
| "Cc1nc(N": 1568, | |
| "(c2ccc": 1569, | |
| "N1CCN": 1570, | |
| "(CC[NH+]": 1571, | |
| "(C)(C)C": 1572, | |
| "c1nc(Cl)": 1573, | |
| "c2cc(O)": 1574, | |
| "cs2)cc1": 1575, | |
| "c2noc(": 1576, | |
| "c1cc(O)": 1577, | |
| "nc2)cc1": 1578, | |
| "ccccc23)": 1579, | |
| "2)CC1)": 1580, | |
| "N1CCN(": 1581, | |
| "(=O)NC": 1582, | |
| "O=C(C=C": 1583, | |
| "OC)c(C": 1584, | |
| "OC(F)F)": 1585, | |
| "nc4)": 1586, | |
| "c1cnn(": 1587, | |
| "(C)cc1": 1588, | |
| "S2": 1589, | |
| "c1nc(C2": 1590, | |
| "c(C)c2)": 1591, | |
| "C1=C(": 1592, | |
| "COC(C)": 1593, | |
| "c3ccc(O": 1594, | |
| "CCC(C2": 1595, | |
| ")ccc12": 1596, | |
| "ncn2": 1597, | |
| "c1cncc": 1598, | |
| "c3)OCO4)": 1599, | |
| "N2CCN": 1600, | |
| "CC1CC": 1601, | |
| "CC(C)N": 1602, | |
| "s2)n1": 1603, | |
| "(=O)N(C)": 1604, | |
| "Nc1ncn": 1605, | |
| "c2cn3": 1606, | |
| "(Cl)c3": 1607, | |
| "CCC1CCCC": 1608, | |
| "CC(=C": 1609, | |
| "Oc1ccc(C": 1610, | |
| "CC(O)C1": 1611, | |
| "=CN": 1612, | |
| "(=O)NC2": 1613, | |
| "[O-])C(": 1614, | |
| "CCCOC": 1615, | |
| "(C)C)C2": 1616, | |
| "2)cc1Cl": 1617, | |
| ")Nc1ccc(": 1618, | |
| "c1n[nH]": 1619, | |
| ")ccc1N": 1620, | |
| "cc(S(=O)": 1621, | |
| "CCOCC": 1622, | |
| "cn2)c1": 1623, | |
| "c4cc5": 1624, | |
| "3CCOCC3": 1625, | |
| "(C)=O)": 1626, | |
| "nnc(": 1627, | |
| "c2c(c1": 1628, | |
| "CN2C(=O)": 1629, | |
| "C1CC2": 1630, | |
| "2)C(=O)N": 1631, | |
| "NC(N": 1632, | |
| "c1nccs1": 1633, | |
| "c2C1": 1634, | |
| "ccccc12)": 1635, | |
| "CCc1nc(": 1636, | |
| "nnnc1": 1637, | |
| "c2c1C": 1638, | |
| "3)n2)c1": 1639, | |
| "c5c(": 1640, | |
| "=C(N)N": 1641, | |
| "2)C(": 1642, | |
| "cn3)": 1643, | |
| "CCC#N)": 1644, | |
| "c1ccc(N)": 1645, | |
| "c1ncc(C": 1646, | |
| "c3ccco": 1647, | |
| "C2C3": 1648, | |
| "c2no": 1649, | |
| "c2C)CC1": 1650, | |
| "c1no": 1651, | |
| "c2c(Cl)": 1652, | |
| "Br)C1": 1653, | |
| "=CC2": 1654, | |
| "(C)n1": 1655, | |
| "=CC": 1656, | |
| "CCn1cn": 1657, | |
| "CCCCC(": 1658, | |
| "OCC1OC(": 1659, | |
| "cs1)": 1660, | |
| "[O-])C2": 1661, | |
| "=C(Cl)": 1662, | |
| "=CC1": 1663, | |
| "oc(=O)": 1664, | |
| "Oc1ccc": 1665, | |
| "C(=S)": 1666, | |
| "C=CCCC": 1667, | |
| "cc1)": 1668, | |
| "c3=O)": 1669, | |
| "[nH]2)c1": 1670, | |
| "(C1": 1671, | |
| "(C)c3)": 1672, | |
| "c(F)c1)": 1673, | |
| "C=CC(C": 1674, | |
| "ccc(N": 1675, | |
| "C(=O)OC1": 1676, | |
| "CC)c1": 1677, | |
| "C12CC3": 1678, | |
| "CCC(C(C)": 1679, | |
| "Cc1nnc(": 1680, | |
| "[O-])c1)": 1681, | |
| "O=C(NCC1": 1682, | |
| "CCSC1": 1683, | |
| "c2)cc1OC": 1684, | |
| "s4)": 1685, | |
| "c2ccnc(N": 1686, | |
| "C(=O)C3": 1687, | |
| "c6)": 1688, | |
| "(C(N)=O)": 1689, | |
| "[NH3+])C": 1690, | |
| "=N)": 1691, | |
| "(CCCCC": 1692, | |
| "3)C2=O)": 1693, | |
| "2)n": 1694, | |
| "CCOC(C)": 1695, | |
| "C(N)=S": 1696, | |
| "ccc3Cl)": 1697, | |
| "ccccc34)": 1698, | |
| "CCCCCCO": 1699, | |
| "CC(=O)OC": 1700, | |
| "Cn1ccnc1": 1701, | |
| "3CC[NH+]": 1702, | |
| "(=O)O": 1703, | |
| "C21": 1704, | |
| "O=C(CC": 1705, | |
| "CCCCC3": 1706, | |
| "F)cc2)n1": 1707, | |
| "c2ccncc2": 1708, | |
| "C1(C)C": 1709, | |
| "C(=C)": 1710, | |
| "c2c(N": 1711, | |
| "n2n1": 1712, | |
| "c1cnc(N": 1713, | |
| "OCC)c1": 1714, | |
| "c(CO": 1715, | |
| "c1cn2": 1716, | |
| "CC1CCCO1": 1717, | |
| "nc2)c1": 1718, | |
| "c1[nH+]": 1719, | |
| "c(F)cc1": 1720, | |
| "CC(O)CO": 1721, | |
| "ccc2F)": 1722, | |
| "c3cc4c(": 1723, | |
| "CCOC3": 1724, | |
| "(Cc2ccc(": 1725, | |
| "c(CO)": 1726, | |
| "c2nc(=O)": 1727, | |
| "cc1F": 1728, | |
| "C(=O)NCC": 1729, | |
| "n2nc(C)": 1730, | |
| ")ccc1Br": 1731, | |
| "N1CCC(": 1732, | |
| "c4)CC3)": 1733, | |
| "c2nc(N)": 1734, | |
| "COCCN1": 1735, | |
| "F)ccc1F": 1736, | |
| "=[N-])": 1737, | |
| "C3)cc1": 1738, | |
| "c1ccc(CO": 1739, | |
| "c(C)c2": 1740, | |
| "cc(O)": 1741, | |
| "Cl)n1": 1742, | |
| "3)c2)cc1": 1743, | |
| "nc5": 1744, | |
| "c2C)c1": 1745, | |
| "O=C(CC1": 1746, | |
| "C(C)S": 1747, | |
| "(CCO": 1748, | |
| "NC1=O": 1749, | |
| "c2ncc(C": 1750, | |
| "#N)c1": 1751, | |
| "C1CCCN": 1752, | |
| "c2n(": 1753, | |
| "N1CC": 1754, | |
| "C(O)=C(": 1755, | |
| "Cc1nn": 1756, | |
| "Nc1": 1757, | |
| "SC(C)": 1758, | |
| "CCC1(C": 1759, | |
| "OCO2": 1760, | |
| "CCCCCC=": 1761, | |
| "CC#CC#": 1762, | |
| "c1cc(N)": 1763, | |
| "F)cc2F)": 1764, | |
| "2)cc(": 1765, | |
| "(C)C(C)C": 1766, | |
| "cs2)": 1767, | |
| "c3cc(OC)": 1768, | |
| "CCC21": 1769, | |
| "c1=O)": 1770, | |
| "(CCOC)": 1771, | |
| "c23)": 1772, | |
| "C(=O)OC)": 1773, | |
| "(C)C)cc2": 1774, | |
| "c2nc3": 1775, | |
| "OO": 1776, | |
| "c2nnnn2": 1777, | |
| "3)cc2)": 1778, | |
| "=CCCC": 1779, | |
| "(Cl)c1Cl": 1780, | |
| "N#Cc1": 1781, | |
| "c(CN": 1782, | |
| "coc(": 1783, | |
| "(C(C)(C)": 1784, | |
| "OCc1ccc": 1785, | |
| "C=CC2": 1786, | |
| "%10": 1787, | |
| "O=C(NC": 1788, | |
| "NC(=O)N(": 1789, | |
| "c4ncc": 1790, | |
| "=C(S": 1791, | |
| "CCOP(=O)": 1792, | |
| "Cc1csc(": 1793, | |
| "CC(C)O1": 1794, | |
| ")cc(C)c1": 1795, | |
| "c1ccc(N(": 1796, | |
| "CSC1": 1797, | |
| "CC2)nc1": 1798, | |
| "c4)cc3": 1799, | |
| "c1cc(=O)": 1800, | |
| "N=[N+]": 1801, | |
| "C(c1ccc(": 1802, | |
| ")cc5)": 1803, | |
| "(C(=O)C3": 1804, | |
| "N1CCOCC1": 1805, | |
| "Cc2cccc": 1806, | |
| "CC2(": 1807, | |
| "nn(C)": 1808, | |
| "n2cc(C": 1809, | |
| "c1nn(": 1810, | |
| "CCC1(CC)": 1811, | |
| "C(O": 1812, | |
| "n3)n": 1813, | |
| "o2)C1": 1814, | |
| "Cl)C(=O)": 1815, | |
| "n3ccc": 1816, | |
| "(C)c2)": 1817, | |
| "c(Br)cc1": 1818, | |
| "n2c(C)": 1819, | |
| "Br)s1": 1820, | |
| "CC(O)(C": 1821, | |
| "C1CC(": 1822, | |
| "nc(C)n1": 1823, | |
| "c6ccc(": 1824, | |
| "C(C)(C": 1825, | |
| "F)cc2)C1": 1826, | |
| "F)C(=O)": 1827, | |
| ")N1CC": 1828, | |
| "(Cl)(Cl)": 1829, | |
| "c1cccc(O": 1830, | |
| "=O)cc2": 1831, | |
| "CC)cc1": 1832, | |
| "4C)": 1833, | |
| "CC2(CC": 1834, | |
| "c1co": 1835, | |
| "C1CCC2": 1836, | |
| "c2c(N)": 1837, | |
| "c2ccsc2)": 1838, | |
| "(Cl)cc4)": 1839, | |
| "C[NH2+]1": 1840, | |
| "c[nH]1": 1841, | |
| "CCC5": 1842, | |
| "c(=O)c3": 1843, | |
| "c1cc(OC": 1844, | |
| "CCCCCCC1": 1845, | |
| "c4c3)": 1846, | |
| "CCO2": 1847, | |
| "[NH2+]1)": 1848, | |
| "C[NH2+]C": 1849, | |
| "c1c[nH+]": 1850, | |
| "Br)cc1)": 1851, | |
| "CCCCC(C)": 1852, | |
| "ccc2C)": 1853, | |
| "CCn1c(": 1854, | |
| "(C(=O)CC": 1855, | |
| "CN(S(=O)": 1856, | |
| "c(F)c3": 1857, | |
| "CC2CCC": 1858, | |
| "=CC(": 1859, | |
| "N2CC": 1860, | |
| "=[NH+]O": 1861, | |
| "ccc12": 1862, | |
| "C2C1": 1863, | |
| "Cc1nc(C)": 1864, | |
| "(C(=O)CS": 1865, | |
| "OC)n1": 1866, | |
| "2)c1=O": 1867, | |
| "c%10": 1868, | |
| "COCC(C)": 1869, | |
| "3)CC2)c1": 1870, | |
| "c(NC2": 1871, | |
| "c3ccc(O)": 1872, | |
| "NC(=O)NC": 1873, | |
| "-c2ccc(": 1874, | |
| "n2nc(C": 1875, | |
| "c2cc(=O)": 1876, | |
| "CCC(N)": 1877, | |
| "CCn1c(S": 1878, | |
| "ncnc3": 1879, | |
| "CCCl": 1880, | |
| "c1nnc(C": 1881, | |
| "(c4ccccc": 1882, | |
| "Fc1ccc(": 1883, | |
| "c3cc(Br)": 1884, | |
| "=Cc1ccc(": 1885, | |
| "c2nc(Cl)": 1886, | |
| "CCS1": 1887, | |
| "COC2": 1888, | |
| "SCC(=O)": 1889, | |
| "c2[nH+]": 1890, | |
| "C(C)(O)": 1891, | |
| "COc1cc(N": 1892, | |
| "n2ccnc2)": 1893, | |
| "(C)C)c(": 1894, | |
| "2)c1)": 1895, | |
| "(F)c3": 1896, | |
| "(F)(F)F": 1897, | |
| "CCC4)": 1898, | |
| "c(Cl)c2": 1899, | |
| "[nH]n1": 1900, | |
| "n2c(C": 1901, | |
| "(C2CC2)": 1902, | |
| "C=CCC1": 1903, | |
| "N=C1": 1904, | |
| "OC12": 1905, | |
| "C4CCCCC": 1906, | |
| "(=O)C2": 1907, | |
| "CCCC2)C1": 1908, | |
| "OC)CC1": 1909, | |
| "O=C(NCC": 1910, | |
| "nc2c(": 1911, | |
| "S1(=O)=O": 1912, | |
| "N#CC1": 1913, | |
| "Oc3ccc(": 1914, | |
| "C(=O)C(C": 1915, | |
| "C3O)": 1916, | |
| "F)cc1)N": 1917, | |
| "CC2(O)": 1918, | |
| "c3cc2": 1919, | |
| "cnn1C": 1920, | |
| "nn2)cc1": 1921, | |
| "Cc1cccs1": 1922, | |
| "2)no1": 1923, | |
| "CC2C1": 1924, | |
| ")C2": 1925, | |
| "OCC[NH+]": 1926, | |
| "SC(": 1927, | |
| "3CCN(": 1928, | |
| "CCCC4)": 1929, | |
| "CCC(C#N)": 1930, | |
| "OCC(": 1931, | |
| "(C(=O)CO": 1932, | |
| "n(C)c1=O": 1933, | |
| "[Se]": 1934, | |
| "c4ccc(OC": 1935, | |
| "F)cc3F)": 1936, | |
| "n(CC)": 1937, | |
| "[S-])": 1938, | |
| "3)C(=O)": 1939, | |
| "N#Cc1cc(": 1940, | |
| "CCCNC(N)": 1941, | |
| "2)nn1": 1942, | |
| "c(Cl)cc(": 1943, | |
| "Cc1ccnc(": 1944, | |
| "C(C)N": 1945, | |
| "oc1C": 1946, | |
| "cc1OC)": 1947, | |
| "4)CC3": 1948, | |
| "c3ncccc3": 1949, | |
| "cnc3": 1950, | |
| "CCC1(C)": 1951, | |
| "c1c(O)": 1952, | |
| "Cc1nn(C": 1953, | |
| "CCC(C1)": 1954, | |
| "c3c[nH]": 1955, | |
| "(Cl)cc4": 1956, | |
| "CCOc1cc": 1957, | |
| "CC(Br)": 1958, | |
| "CN(CC1": 1959, | |
| "c4cc(F)": 1960, | |
| "Cc1c(N": 1961, | |
| "Cc1cc(F)": 1962, | |
| "C(C)CC)": 1963, | |
| "c3o": 1964, | |
| "c2c[nH+]": 1965, | |
| "[O-])N": 1966, | |
| "OC)c2)": 1967, | |
| "C2CCC1": 1968, | |
| "3)nc2": 1969, | |
| "Cc1ccc(S": 1970, | |
| "=O)ccc1": 1971, | |
| ")cccc2": 1972, | |
| "CCSCC1": 1973, | |
| "N(C)C)": 1974, | |
| "c3nccc": 1975, | |
| ")cc3)C2": 1976, | |
| "OC)cc1)": 1977, | |
| "3)n1": 1978, | |
| "CC1=N": 1979, | |
| "CC(C1": 1980, | |
| "n1cc": 1981, | |
| "2CCN(": 1982, | |
| "CC(CC)": 1983, | |
| "(NN)": 1984, | |
| "(C)CC2)": 1985, | |
| "F)cc1F)": 1986, | |
| "Br)cc(C": 1987, | |
| "Cn1c(": 1988, | |
| "2)cc1F": 1989, | |
| "Cc1nc(C2": 1990, | |
| "c1ccnc(N": 1991, | |
| "OCC(C)C)": 1992, | |
| "(C)C)cc(": 1993, | |
| "csc1": 1994, | |
| "3)c(": 1995, | |
| "SS": 1996, | |
| "c2c3c(": 1997, | |
| "CCCC2)n1": 1998, | |
| "C#CCO": 1999, | |
| "c1ccoc1": 2000, | |
| "C(O)C2": 2001, | |
| "4CC[NH+]": 2002, | |
| "(C)CC3)": 2003, | |
| "CC1CCCC(": 2004, | |
| "c1[nH]c(": 2005, | |
| "(F)c1F": 2006, | |
| ")N(": 2007, | |
| "c1nc(=O)": 2008, | |
| "c2c(O)": 2009, | |
| "c2nn(": 2010, | |
| "CCC(C)C1": 2011, | |
| "2C(": 2012, | |
| "C3)n": 2013, | |
| "cnn2": 2014, | |
| "2)C(C)": 2015, | |
| "CC4)cc3": 2016, | |
| "no2)": 2017, | |
| "C2(": 2018, | |
| "[O-])cn1": 2019, | |
| "=C(C)C": 2020, | |
| "n6": 2021, | |
| "c1noc(": 2022, | |
| "c2cnn(": 2023, | |
| ")N1CCN": 2024, | |
| "N2CCCC2": 2025, | |
| ")cc(=O)": 2026, | |
| "o2)n1": 2027, | |
| "OC)c3)": 2028, | |
| "c5cc(": 2029, | |
| "c1O": 2030, | |
| "Cc1c[nH]": 2031, | |
| "OCC(C)C": 2032, | |
| "2CC[NH+]": 2033, | |
| "O=S1(=O)": 2034, | |
| "C(C)(": 2035, | |
| "[Si](": 2036, | |
| "c2cc1OC": 2037, | |
| "c(C)s1": 2038, | |
| "c[nH+]1": 2039, | |
| ")cc3)n": 2040, | |
| ")C": 2041, | |
| "c-3": 2042, | |
| "CC2(C": 2043, | |
| ")ccc1C": 2044, | |
| "N3C(=O)": 2045, | |
| "Nc1cn": 2046, | |
| "CC1CN": 2047, | |
| "Br)c1)": 2048, | |
| "CC4)cc3)": 2049, | |
| "OC)c2": 2050, | |
| "3CCN": 2051, | |
| "C1(O)": 2052, | |
| "nn(": 2053, | |
| "=O)cc2)": 2054, | |
| "(C)CCO": 2055, | |
| "c4nc(": 2056, | |
| "c(NS(=O)": 2057, | |
| "c2nn[n-]": 2058, | |
| "ccc6": 2059, | |
| "c3nnc(": 2060, | |
| "c2cnc(N": 2061, | |
| "co1": 2062, | |
| "4)C3)": 2063, | |
| "c(C[NH+]": 2064, | |
| "CCn1cc": 2065, | |
| ")cc1F": 2066, | |
| "c2nnc3": 2067, | |
| "OCCO)": 2068, | |
| "3)n2": 2069, | |
| "n2ccnc2": 2070, | |
| "c2cn(C)": 2071, | |
| "c1ncn2": 2072, | |
| "C1CCC1": 2073, | |
| "#N)cc2": 2074, | |
| "c2ccnn2": 2075, | |
| "N1S(=O)": 2076, | |
| "[CH]": 2077, | |
| "C2CC2)c1": 2078, | |
| "CCC12C": 2079, | |
| "c6ccc7": 2080, | |
| "no1)": 2081, | |
| "C2(C)": 2082, | |
| "Nc1nc(": 2083, | |
| "2CC3": 2084, | |
| "c2co": 2085, | |
| "c1ccs": 2086, | |
| "CC2)cn1": 2087, | |
| "c1csc(C": 2088, | |
| "C(C)=": 2089, | |
| "CCCN(CCC": 2090, | |
| "c(N)n": 2091, | |
| "Cc1c(Cl)": 2092, | |
| "oc2c1": 2093, | |
| "F)cc3)n": 2094, | |
| "c1)C(": 2095, | |
| "CC1CC2": 2096, | |
| "C2CCN": 2097, | |
| "c(N)n1": 2098, | |
| ")C(C)C": 2099, | |
| "(CC=C)": 2100, | |
| "COCC(": 2101, | |
| "C(O)C(": 2102, | |
| "c2ccc(I": 2103, | |
| "[O-])c(N": 2104, | |
| "c1)CCC2": 2105, | |
| "c(OC)c3)": 2106, | |
| ")C(": 2107, | |
| "2)O1": 2108, | |
| "c2cn[nH]": 2109, | |
| "CCn1cc(": 2110, | |
| "C=CCN1": 2111, | |
| "c1)OCCO": 2112, | |
| "C)CC3)": 2113, | |
| "CCC1=O": 2114, | |
| "OCCO4)": 2115, | |
| "CNc1n": 2116, | |
| "(CC3": 2117, | |
| "sc(N": 2118, | |
| "2)cs1": 2119, | |
| "C1(C(=O)": 2120, | |
| "CCC1O": 2121, | |
| "(C)C)cc3": 2122, | |
| "c1ccnc(": 2123, | |
| "=N1": 2124, | |
| "Cn1nccc1": 2125, | |
| "C1=N": 2126, | |
| "O=C(OC": 2127, | |
| "c1c(Br)": 2128, | |
| "c4ccc(N": 2129, | |
| "c3ccc(n4": 2130, | |
| "c1sc(": 2131, | |
| "COc1c(C)": 2132, | |
| "CSc1ccc(": 2133, | |
| "c1ccc2n": 2134, | |
| "3)CC2)n1": 2135, | |
| "CC(O)C(": 2136, | |
| "c2ccc(N)": 2137, | |
| "c4ccncc": 2138, | |
| "CCn1cc(C": 2139, | |
| "C1=C": 2140, | |
| "[O-])s1": 2141, | |
| "(=O)CC1": 2142, | |
| "(CCN": 2143, | |
| "n3C)": 2144, | |
| "c2ccn": 2145, | |
| "CC(C)Cn1": 2146, | |
| "c1ccn": 2147, | |
| ")cc(N": 2148, | |
| "2CCC": 2149, | |
| "ccc2o1": 2150, | |
| "COc1cn": 2151, | |
| "c(=O)c(": 2152, | |
| "Cc1ncc": 2153, | |
| "OC5": 2154, | |
| "c4ccco": 2155, | |
| "Oc2ccc(C": 2156, | |
| "(=O)NCC": 2157, | |
| "CC3CCC2": 2158, | |
| "CCOc1cc(": 2159, | |
| "Nc1nc(N": 2160, | |
| "oc2": 2161, | |
| "CC2)s1": 2162, | |
| "nn2)": 2163, | |
| "[NH2+]C3": 2164, | |
| "cc2c(": 2165, | |
| "Cn1nc(": 2166, | |
| "cc2F)": 2167, | |
| "n2cnc3": 2168, | |
| "CCCCN(": 2169, | |
| "c1)OCO2)": 2170, | |
| "(Cc2cccc": 2171, | |
| "C(c2ccc": 2172, | |
| "CC2)cc1C": 2173, | |
| "c3ccc(C4": 2174, | |
| "C2CCCC2": 2175, | |
| "CC(OC)": 2176, | |
| "c(C=O)": 2177, | |
| "C(C#N)=C": 2178, | |
| "CCc1c(C)": 2179, | |
| "Nc1cccc(": 2180, | |
| "-4": 2181, | |
| "c2ccc(n3": 2182, | |
| "Br)c2": 2183, | |
| "CC1CCCN": 2184, | |
| "c3ccs": 2185, | |
| "Br)CC1": 2186, | |
| ")[NH+]1": 2187, | |
| "[O-])cn": 2188, | |
| "C#N)cc1": 2189, | |
| "c(I)": 2190, | |
| "F)cc21": 2191, | |
| "c(C#N)c1": 2192, | |
| "C[NH+](": 2193, | |
| "[NH+]2CC": 2194, | |
| "c3)cc2": 2195, | |
| "c2cnc(": 2196, | |
| "cc(F)": 2197, | |
| "c2)cn1": 2198, | |
| "c(OC)cc2": 2199, | |
| "C2(C)C": 2200, | |
| "N1CCCCC1": 2201, | |
| "CC(C)C(C": 2202, | |
| "B(": 2203, | |
| "CC(=O)NC": 2204, | |
| "=S)N1": 2205, | |
| "cccc2": 2206, | |
| "O)C1": 2207, | |
| "F)cc(F)": 2208, | |
| "c34)": 2209, | |
| "C=CCC": 2210, | |
| "(C)c(C": 2211, | |
| "N1C": 2212, | |
| "c1ccc(NC": 2213, | |
| "(C(=O)C(": 2214, | |
| "Cc1cn2": 2215, | |
| "c(C)cc2": 2216, | |
| "O)ccc1": 2217, | |
| "c(C)o1": 2218, | |
| ")c1ccc": 2219, | |
| "c1cnn2": 2220, | |
| "CC3)cc2)": 2221, | |
| "C=C=": 2222, | |
| ")N(C)": 2223, | |
| "OP": 2224, | |
| "[NH+](CC": 2225, | |
| "C1CO": 2226, | |
| "C2C": 2227, | |
| "CC#N)": 2228, | |
| "[O-])c(C": 2229, | |
| "(=S)": 2230, | |
| "CCCC(N": 2231, | |
| "FC(F)": 2232, | |
| "Cc1nccn1": 2233, | |
| "CCc2cc(": 2234, | |
| "3c(": 2235, | |
| "cccnc2": 2236, | |
| "CCC1C": 2237, | |
| "Sc2n": 2238, | |
| "C=C(C#N)": 2239, | |
| "COc1n": 2240, | |
| "O)CC1": 2241, | |
| "[nH]c(C": 2242, | |
| ")N(C)C": 2243, | |
| "5)ccc4": 2244, | |
| "4)C2)C3)": 2245, | |
| ")cc1Cl": 2246, | |
| "Br)c(": 2247, | |
| "(F)F": 2248, | |
| "cc1F)": 2249, | |
| "4CCCCC4)": 2250, | |
| "C=O)": 2251, | |
| "5)cc4": 2252, | |
| "OC1(C)C": 2253, | |
| "5)c4": 2254, | |
| "Cc3ccccc": 2255, | |
| "CCc2ccc": 2256, | |
| "c1ccc(C#": 2257, | |
| ")cc1C": 2258, | |
| "O=C(CCC": 2259 | |
| }, | |
| "merges": [ | |
| "c c", | |
| "C C", | |
| "( C", | |
| "c 1", | |
| "O )", | |
| "= O)", | |
| "( =O)", | |
| "cc c", | |
| "(C )", | |
| "c 2", | |
| "C (=O)", | |
| ") cc", | |
| "+ ]", | |
| "[ N", | |
| "CC C", | |
| "c1 cc", | |
| "[N H", | |
| "c1 ccc", | |
| "c (", | |
| "C (", | |
| "c 3", | |
| "2 )", | |
| "F )", | |
| "C 1", | |
| "CC CC", | |
| "c2 cc", | |
| "O C", | |
| "c1cc cc", | |
| "N C(=O)", | |
| ")cc 1", | |
| "CC 1", | |
| "(=O) N", | |
| "(C) C", | |
| "- ]", | |
| "C O", | |
| "c1ccc (", | |
| "[ O", | |
| "[O -]", | |
| "n 1", | |
| "[NH +]", | |
| "c2 ccc", | |
| "3 )", | |
| "(C l", | |
| "( F)", | |
| "c1cccc c1", | |
| "cc ccc", | |
| "CC O", | |
| "C(=O) N", | |
| "2 +]", | |
| "[NH 2+]", | |
| "c2cc ccc", | |
| "( CC", | |
| "C 2", | |
| "[O-] )", | |
| "c n", | |
| "c1 n", | |
| "S (=O)", | |
| "[ n", | |
| "N )", | |
| "O =", | |
| "CC N", | |
| "(C (=O)", | |
| "[n H", | |
| "(C (=O)N", | |
| "c 4", | |
| "(Cl )", | |
| "B r", | |
| "CC (C)", | |
| "C (C)", | |
| "[nH ]", | |
| "(C)C )", | |
| "CC (", | |
| "2 )cc1", | |
| "c (C", | |
| "3 +]", | |
| "[NH 3+]", | |
| "c3 ccc", | |
| "c2ccc (", | |
| "C N", | |
| "C (C", | |
| "c (C)", | |
| "c3 ccccc", | |
| "C l", | |
| "CC CCC", | |
| "C =", | |
| "cc (", | |
| "c2 )", | |
| "c2 n", | |
| "cc 1", | |
| "OC )", | |
| "c2ccccc 2", | |
| "O= C(", | |
| "c1cc (", | |
| "F )cc", | |
| "c1ccc (C", | |
| "CC (=O)N", | |
| ") N", | |
| "n 2", | |
| "CC 2", | |
| "[N +]", | |
| "2) c1", | |
| "C )", | |
| "[NH3+] )", | |
| "CC [NH+]", | |
| "Br )", | |
| "4 )", | |
| "c( N", | |
| "CCC (", | |
| "= O", | |
| "(Cl )cc", | |
| "(F) (F)", | |
| "c1 )", | |
| "c (=O)", | |
| "c3 cc", | |
| "[N+] (=O)", | |
| "C c1ccc(", | |
| "CC (=O)", | |
| "c2cc cc", | |
| "c1ccc 2", | |
| "c1cccc (", | |
| "CC 2)", | |
| "N 1", | |
| "C( F)", | |
| "C 3", | |
| "s 1", | |
| "c3ccccc 3", | |
| "C [NH+]", | |
| "CCC 1", | |
| "ccc 2", | |
| "C c1", | |
| "n c(", | |
| "n c1", | |
| "O CC", | |
| "C c1cc", | |
| "CCCC CCCC", | |
| "C( O)", | |
| "N 2", | |
| "= C", | |
| "c3ccc (", | |
| "OC (C)", | |
| "C c1n", | |
| "c3 )", | |
| "CO C(=O)", | |
| "Cl )", | |
| "c (Cl)", | |
| "# N)", | |
| "C(F) (F)", | |
| "c 5", | |
| "2) CC1", | |
| "(CC )", | |
| "O C(=O)", | |
| "( O)", | |
| "CC [NH2+]", | |
| "1 )", | |
| "cc 2", | |
| "= C(", | |
| "C [NH2+]", | |
| ")cc c1", | |
| "CCN (", | |
| "O=C( N", | |
| "F )cc1", | |
| "(F)(F) F)", | |
| "n n", | |
| "= N", | |
| ")cc 2", | |
| "CO c1ccc(", | |
| "c4 ccccc", | |
| "2) C1", | |
| "C S", | |
| "CC(C) (C)", | |
| "CCCC 1", | |
| "c( F)", | |
| "c1 cn", | |
| "CCO C(=O)", | |
| "c2cc (", | |
| "CCC N", | |
| "CCC (C)", | |
| "CC 3)", | |
| "n c2", | |
| "NC(=O) N", | |
| "C (C)C", | |
| "= S", | |
| "c4 ccc", | |
| "CC( O)", | |
| "CC 3", | |
| "o 1", | |
| "c s", | |
| "CCC O", | |
| "CCC 2", | |
| "(C (C)", | |
| "(Cl )cc1", | |
| "c1ccc2 c(", | |
| "c n1", | |
| "CC (C", | |
| "C(=O)N 1", | |
| "( N)", | |
| "c2 c(", | |
| "[ S", | |
| "C n1", | |
| "= [NH+]", | |
| "C c1ccc", | |
| "CCCCC 1", | |
| "n 3", | |
| "C c1cc(", | |
| "O= C(C", | |
| "c2 c1", | |
| "n cc", | |
| "c1cc (C", | |
| "2) n1", | |
| "c1cccc (C", | |
| "CCC (C", | |
| "c2ccc 3", | |
| "CC )", | |
| "c2 cn", | |
| "c (C(=O)N", | |
| "c1 2", | |
| ")N 1", | |
| "[nH +]", | |
| "[S i", | |
| "(CC (=O)N", | |
| "c3cc cc", | |
| "ccc 3", | |
| "C NC(=O)", | |
| "[NH+] 1", | |
| "CC =", | |
| ")cc (", | |
| "CC (C)C", | |
| "O C1", | |
| "n (", | |
| "c2cc cc(", | |
| "[Si ]", | |
| "[NH+] 2", | |
| "OC 2", | |
| "CC1 )", | |
| "c4ccccc 4", | |
| "CC n1", | |
| "cc cc", | |
| "c2ccc (C", | |
| "c(C) c1", | |
| "(C) cc", | |
| "N #", | |
| ")cc 2)", | |
| "CC NC(=O)", | |
| "c1 c(", | |
| "CC 2)cc1", | |
| "CC S", | |
| "3) n", | |
| "OC (C", | |
| "=O) cc1", | |
| "c1cc 2", | |
| "c2 )cc1", | |
| "n (C)", | |
| "5 )", | |
| "N S(=O)", | |
| "NC(=O) C(", | |
| "c1 C", | |
| "c [nH]", | |
| "N C(", | |
| "( [O-])", | |
| "c3 n", | |
| "(C) C(=O)", | |
| "c( OC)", | |
| "# N", | |
| ")cc 3)", | |
| "CCCC 2", | |
| "CN 1", | |
| "c( N)", | |
| "C c1ccc(C", | |
| "(C) (=O)", | |
| "C (C)C)", | |
| "c 6", | |
| "O= C1", | |
| "n c(N", | |
| "C[NH+] 1", | |
| ")cc 3", | |
| ") C(=O)", | |
| "c (C(=O)", | |
| "C 2)", | |
| "CC 2)c1", | |
| "c1cccc 2", | |
| "Br )cc1", | |
| "N (", | |
| "cc (C", | |
| "C1 CC1", | |
| "S (C)(=O)", | |
| "n c(C", | |
| "CC C(=O)", | |
| "ccc (", | |
| "CC C(=O)N", | |
| "[O-] )cc1", | |
| "c( NC(=O)", | |
| "C( N)", | |
| "CN (", | |
| "CCN 1", | |
| "c1ccc( N", | |
| "c3 c(", | |
| "C 4", | |
| "[O-]) c1", | |
| "O C(", | |
| "c1ccc (C)", | |
| "(C(=O)N 2", | |
| ")cc 2)cc1", | |
| "[nH] 1", | |
| "c (Cl)cc", | |
| "O CCO", | |
| "C1 =O", | |
| "C c1cccc(", | |
| "= C2", | |
| "n (C", | |
| "CCC [NH+]", | |
| "CCCC (", | |
| "=S )", | |
| "O 1", | |
| "n n1", | |
| "CCC 3", | |
| "Br) c1", | |
| "NC(=O) C1", | |
| "[Si] (C)", | |
| "(CC (=O)", | |
| "cc 3", | |
| "OC O", | |
| ") C1", | |
| "c4ccc (", | |
| "N1 C(=O)", | |
| "n 2)", | |
| "c2) c1", | |
| "C(C) (C)C", | |
| "n c3", | |
| "O CC(=O)N", | |
| "c2ccc3 c(", | |
| "c4 )", | |
| "=S )N", | |
| "N c1n", | |
| "Cc1 cn", | |
| "c5 ccccc", | |
| "NC(=O) C2", | |
| "(N) =O)", | |
| "CC S(=O)", | |
| "F)cc 2", | |
| "P (=O)", | |
| "ccccc 2", | |
| "(Cl) c1", | |
| "O) cc1", | |
| "c1ccc(C 2", | |
| "CC c1n", | |
| "C(C) (C)", | |
| "c(Cl) c1", | |
| "c2ccc( N", | |
| "C( N", | |
| "n cn", | |
| "(C 2", | |
| "c( S", | |
| "c3 cc(", | |
| "( CCC", | |
| "C #", | |
| "c(F) c1", | |
| "c2 s", | |
| "3) C2", | |
| "C S(=O)", | |
| "CCO CC1", | |
| "CC1 (C)", | |
| "OCC )", | |
| "CN (C(=O)", | |
| "c( O)", | |
| "n cc1", | |
| "cc c1", | |
| "CO c1cc(", | |
| "3 CCCC", | |
| "Cc1cc (C)", | |
| "N2 C(=O)", | |
| "CC (CC", | |
| "CC[NH+] 1", | |
| "c1 =O", | |
| "N =", | |
| "C 3)", | |
| "c s1", | |
| "n 3)", | |
| "c3ccc 4", | |
| "I )", | |
| "c2cc 3", | |
| "CC (C)C)", | |
| "CC 4", | |
| "C )cc1", | |
| "c2n c(", | |
| "s 2)", | |
| "C(F)(F) F", | |
| "C= C", | |
| "C(=O)N C(", | |
| "c(C 2", | |
| "c2) CC1", | |
| "c1n cc", | |
| "(C) C1", | |
| "(C O)", | |
| "CC(=O)N 1", | |
| "(C) c1", | |
| "CCC( O)", | |
| "c4 cc", | |
| "C(=O)N 2", | |
| "s c1", | |
| "( [NH3+])", | |
| "CO C1", | |
| "[O-]) C1", | |
| "OC )cc1", | |
| "c1ccc( O", | |
| "C(=O)N (", | |
| "CO c1ccc", | |
| "(=O)N 2", | |
| "C c1cccc", | |
| "(C)C )cc1", | |
| "n1 )", | |
| "3 )cc1", | |
| "=C( N", | |
| "l )", | |
| "CCC =", | |
| "(F) c1", | |
| "c(C) cc", | |
| "c2n cc", | |
| "(Cl)cc 2", | |
| "(C #N)", | |
| "OC 3", | |
| "n 2)cc1", | |
| "ccc2 1", | |
| "c1 s", | |
| "(C)C (C)", | |
| "(C(=O)N C", | |
| "CN (C)", | |
| "[NH2+] C", | |
| "OC) c1", | |
| "C(C #N)", | |
| "c1n c(", | |
| "CC 4)", | |
| "CO c1cc", | |
| "( N", | |
| "CCCCC 2", | |
| "C1 =", | |
| "F)cc 2)", | |
| "C1 )", | |
| "s1 )", | |
| "n c(C)", | |
| "ccccc 3", | |
| "=O) c1", | |
| "C OC", | |
| "o 2)", | |
| "CO c1cc(C", | |
| "c2cc (Cl)", | |
| "CCO CCO", | |
| "CCCC O", | |
| "c3cc cc(", | |
| "CCN (CC)", | |
| "c2ccc( OC", | |
| "c(C (C)", | |
| "N (C", | |
| "N (C)", | |
| "F)cc c1", | |
| "C(C O)", | |
| "N (C(=O)", | |
| "[NH2+] C1", | |
| "c 7", | |
| "OC(C) =O)", | |
| "c3 cn", | |
| "n 4", | |
| "CCN (C", | |
| "CN (C", | |
| "(CC O)", | |
| "S C", | |
| "c5ccccc 5", | |
| "= C1", | |
| "c1 cs", | |
| "c1ccc( F)", | |
| "o c(", | |
| "(C)C 2", | |
| "C (C(=O)", | |
| "c(N 2", | |
| "CCO CC2)", | |
| "CC c1ccc(", | |
| "( CCCC", | |
| "c2cc (C", | |
| "c2ccc( Br", | |
| "c3ccc (C", | |
| "[nH] c(", | |
| "3) CC2)", | |
| "NC(=O) C", | |
| "O CCC", | |
| "( c2ccccc", | |
| "n o1", | |
| "(=O)N 1", | |
| "c(OC) c1", | |
| "c2cc (C)", | |
| "ccc 4", | |
| "C(O) C(O)", | |
| "CCO C1", | |
| "O CC1", | |
| "c2ccc (C)", | |
| "c1cc2 c(", | |
| "c2cccc 3", | |
| "O) cc", | |
| "o 1)", | |
| "=O) cc", | |
| "c [nH+]", | |
| "CC OC", | |
| "O= S(=O)", | |
| "CCCC (C)", | |
| "N =C", | |
| "CCC n1", | |
| "3 CCO", | |
| "c4 cccc", | |
| "c2 C)", | |
| "c2n cn", | |
| "C( =", | |
| "c( Br)", | |
| "CCC 4", | |
| "c2 cs", | |
| "c2cccc (C", | |
| "c( O", | |
| "[n +]", | |
| "CCCCC 2)", | |
| "(C)C) c1", | |
| "C1 CCCCC1", | |
| "F)cc 3)", | |
| ") C(=O)N", | |
| "Cc1cc (C", | |
| "(Cl)cc c1", | |
| "CCCC 2)", | |
| "c1n nc(", | |
| "c1 2)", | |
| "n c2)", | |
| "C( =C", | |
| "c1 c(C)", | |
| "(Cl)cc 2)", | |
| "ccccc 6", | |
| "C1 2", | |
| "% 1", | |
| "C( NC(=O)", | |
| "OC(C O)", | |
| "(CC 2", | |
| "c2cc (F)", | |
| "c1ccc( N2", | |
| "o 2)cc1", | |
| "c1ccc s1", | |
| "[O-] )cc", | |
| "C2 =O)", | |
| "c1ccc nc1", | |
| "=C( N)", | |
| "C= C1", | |
| "c1cc( N", | |
| "3 CCCCC", | |
| "CCC )", | |
| "C( =S)N", | |
| "c(C #N)", | |
| "c2 1", | |
| "[N -]", | |
| "CC O)", | |
| "n2 cc", | |
| "c( S(=O)", | |
| "CCCN (", | |
| "C (C(=O)N", | |
| "c1n cn", | |
| "n1 C", | |
| "c2ccc (F)", | |
| "C[NH+] 2", | |
| "NC(=O) CS", | |
| "c2n nc(", | |
| "( O", | |
| "n2 cn", | |
| "(C (C)C)", | |
| "c3ccccc 2", | |
| "n 2)c1", | |
| "[NH2+] C2", | |
| "Cc1cc 2", | |
| "N) =O)", | |
| "s 3)", | |
| "O C(=O)N", | |
| "C1 CCC", | |
| "F)cc 3", | |
| "CCCCC 1)", | |
| "O c1ccc(", | |
| "(C)C )cc", | |
| "N C(C)", | |
| "CN1 C(=O)", | |
| "= [NH2+]", | |
| "C1 O", | |
| "c( OC", | |
| "c6 ccccc6", | |
| "S 1", | |
| "CC1 (", | |
| "S CC(=O)N", | |
| "c1 [nH]", | |
| "c2) C1", | |
| "c2 c(C)", | |
| "= CC(=O)", | |
| "c3ccc4 c(", | |
| "O C(F)(F)", | |
| "(N) (=O)", | |
| "CCC (CC)", | |
| "c1 c[nH]", | |
| "c o", | |
| "CC (C(=O)", | |
| "C O)", | |
| "n o", | |
| "CCN (CC", | |
| "s 2)cc1", | |
| "O CCCC", | |
| "C(=O) OC", | |
| "c2 n1", | |
| "C2 )cc1", | |
| "F) c1", | |
| "nc1 2", | |
| "Br )cc", | |
| "N C1", | |
| "CCN C(N", | |
| "3) CC1", | |
| "c2) n1", | |
| "c2 [nH]", | |
| "C= C(", | |
| "3CCO CC3)", | |
| "= C(O)", | |
| "n cc2", | |
| "C #N)", | |
| "c1cc ncc1", | |
| "c( Br)c1", | |
| "CCCC CC1", | |
| ")cc2 1", | |
| "- 2", | |
| "C 2)c1", | |
| "Cc1 cs", | |
| "N 3", | |
| "O= [N+]", | |
| "Br )ccc1", | |
| "c2 =O)", | |
| "C c1ccc2", | |
| "C c2ccc", | |
| "NC(=O) CO", | |
| "C1 CCCC1", | |
| "3) c1", | |
| "c(F) c(F)", | |
| "C[NH+] (C", | |
| "C) c1", | |
| "c1cc (C)", | |
| "C #N", | |
| "NC( =S)N", | |
| "F)cc1 )", | |
| "n nc1", | |
| "CC(C) O", | |
| "c5 ccc", | |
| "O) c1", | |
| ")cc 2)c1", | |
| "S (N)(=O)", | |
| "CC2) CC1", | |
| "C 5", | |
| "CC #", | |
| "4) CC3)", | |
| "O [Si](C)", | |
| "CCCC (C", | |
| "CCN 2", | |
| "CC1 2", | |
| "c1c( F)cc", | |
| "n n2", | |
| "CO c1ccc2", | |
| "CC( N", | |
| "c2n c(C", | |
| "O=C(N C1", | |
| "C= C(C)", | |
| "cc( N", | |
| "n (CC", | |
| "3 CC3)", | |
| "n 2)CC1", | |
| "o c(C", | |
| "n c3)", | |
| "c4 c(", | |
| "CC1 CCC", | |
| "(Cl)cc 3", | |
| "Cl )cc1", | |
| "c2cc( Br)", | |
| "O C(F)", | |
| "c2cc ncc", | |
| "n [nH]", | |
| "O CC2", | |
| "(Cl)cc 3)", | |
| "Cc1n c(", | |
| "CN 2", | |
| "nc( N)", | |
| "C2 =O)cc1", | |
| "nc2 c1", | |
| "CCCC (=O)", | |
| "(F) F)", | |
| "C c2ccccc", | |
| "(C) CC1", | |
| "c3 s", | |
| "NC(=O) N2", | |
| "CCCC 1)", | |
| "O P(=O)", | |
| "N c1ccc(", | |
| "C(N) =O", | |
| ")cc 2)CC1", | |
| "6 )", | |
| "CC2) n1", | |
| "n cn1", | |
| "CCC S", | |
| "O CC(=O)", | |
| "2)C1 =O", | |
| "CC2 )ccc1", | |
| ")cc 4", | |
| ")cc cc1", | |
| "C(=O)N (C", | |
| "s c2c1", | |
| "C(=O) C1", | |
| "o 3)", | |
| "c1cc (Cl)", | |
| "OC) c(OC)", | |
| "Cc1ccc( N", | |
| "c3ccc( OC", | |
| "c2cc 1", | |
| "CC1 =", | |
| "C( CC)", | |
| "CC =C", | |
| "c2c( F)cc", | |
| "C( OC", | |
| "c1) OCO", | |
| "c3 ncc", | |
| "N (CC", | |
| "c1n c(N", | |
| "c(=O) n2", | |
| "c3ccc( N", | |
| "c 8", | |
| "c3 C)", | |
| "CC1 (C", | |
| "CC1 C", | |
| "c1) C(=O)", | |
| "cc 4", | |
| "CN (CC", | |
| "ccc2 c1", | |
| "ccccc 4", | |
| "c4ccc 5", | |
| "C(=O)N C1", | |
| "(C)C 3", | |
| "CC( =", | |
| "CC (F)(F)", | |
| "cc( Br)", | |
| "(C(=O) C2", | |
| "CC[NH+] 2", | |
| "CC( O", | |
| "C(C) O", | |
| "3) C1", | |
| "CCC (CC", | |
| "[O-]) CC1", | |
| "CCC= CCC=", | |
| "[NH3+] C1", | |
| "c(=O) n1", | |
| "cn 2", | |
| "[NH+] 3", | |
| "[NH2+] 1", | |
| "CCC 2)", | |
| "( OC)", | |
| "cc nc1", | |
| "c5 ccc(", | |
| "CC2) C1", | |
| "NC(=O) N1", | |
| "c1 N", | |
| "(C(C) =O)", | |
| "CCC( N", | |
| "c3 c2", | |
| "CC l)", | |
| "C (Cl)", | |
| "c2ccc s2)", | |
| "Cc1 c(", | |
| "CC(C) C1", | |
| "3CCCC 3", | |
| "C(N) =O)", | |
| "[O-] )cc2", | |
| "n c4", | |
| "( c3ccccc", | |
| "[NH2+] C)", | |
| "(C)C) C1", | |
| "n1 cn", | |
| "O 2", | |
| "c3 nn", | |
| "OC(C) (C)", | |
| "c1n c(C", | |
| "c3cccc 4", | |
| "c2ccc nc2", | |
| ") c1ccc(", | |
| "CC1 (C)C", | |
| "c3cc 4", | |
| "n c1)", | |
| "CO c1cccc", | |
| "N C2", | |
| "Cc1 s", | |
| "CCCC 3", | |
| "CC(=O)N 2", | |
| "=N NC(=O)", | |
| "= C(C)", | |
| "[NH+] (C)", | |
| "CC(CC (C", | |
| "= C(C", | |
| "# C", | |
| "F) CC1", | |
| "=C (C(=O)", | |
| "C(=O) C(", | |
| "s c2", | |
| "c1ccc o1", | |
| "[nH] c1", | |
| "(=O) C1", | |
| "[NH2+] C(", | |
| "c2cc3 c(", | |
| "=C( [O-])", | |
| "c3cc (Cl)", | |
| "c1cccc n1", | |
| "o c1", | |
| "( NC(=O)", | |
| "CC(C) (O)", | |
| "c1ncc cc1", | |
| "OCC (C", | |
| "CCO 1", | |
| "3 C)", | |
| "Cl) c1", | |
| "CCC (C)C", | |
| "S c1n", | |
| "ccccc 7", | |
| "cccc c12", | |
| "#N )cc1", | |
| "O c2ccc(", | |
| "CC OC2", | |
| "c3 nc(", | |
| "C(=O) C2", | |
| "Cc1n o", | |
| "c5 )", | |
| "n2 ccc", | |
| "Cc1 [nH]", | |
| "3)n 2)cc1", | |
| "(Cl) c2", | |
| "C1 C", | |
| "CC(C O)", | |
| "O CC(O)", | |
| "= C(C#N)", | |
| "CCCO 1", | |
| ")cc 4)", | |
| "n1 2", | |
| "[nH] c2c1", | |
| "cc cc1", | |
| "CCC N1", | |
| "c1 c(C", | |
| "Cc1n n(C)", | |
| "c3cc (C)", | |
| "N C", | |
| "2) nc1", | |
| "C3 =O)", | |
| "OC (C)C)", | |
| "CCO CC1)", | |
| "OC (C)C", | |
| "(Cl) c2)", | |
| "4 CCCC", | |
| "c2 c[nH]", | |
| "C= CC(=O)", | |
| "O C(=O)N1", | |
| "C1 CCN", | |
| "S )", | |
| "c2n c(N", | |
| "[NH2+] CC", | |
| "C= N", | |
| "c %1", | |
| "CCN (C)", | |
| "=[NH2+] )", | |
| "c(C) n1", | |
| "C( =[NH+]", | |
| "n [nH]1", | |
| "(Cl)cc1 )", | |
| "= CC=", | |
| "c2) OCO", | |
| "cc2 1", | |
| "c1cc( Br)", | |
| "F)cc1 F", | |
| "c1cc (F)", | |
| "CCCC )", | |
| "(F) c2)", | |
| "CCC( O", | |
| "C(=O) O", | |
| ")N (C", | |
| "(C(=O) C", | |
| "=C2 S", | |
| "= C)", | |
| "NC(=O) CC", | |
| "NC(=O) C3", | |
| "c(Cl) c2)", | |
| "s 2)c1", | |
| "C= CC=", | |
| "CCN S(=O)", | |
| "CC( N)=O)", | |
| "c(Cl) c3)", | |
| "OC)c1 OC", | |
| "(C) (C)", | |
| "OCCO 2", | |
| "F C(F)(F)", | |
| "c4 cc(", | |
| "3CCCC 3)", | |
| "Cl) CC1", | |
| "ccccc2 c1", | |
| "ccc (C", | |
| "cn 2)", | |
| "CO CCO", | |
| "CC1 (O)", | |
| "nc(N 2", | |
| "[nH] 1)", | |
| "CC(C) C(", | |
| "o 2)c1", | |
| "F) C1", | |
| "c7 ccccc7", | |
| "cc (C)", | |
| "F)cc (", | |
| "c3 c(C)", | |
| "[nH] 2)", | |
| "(Cl) c3)", | |
| "c2ccc o2)", | |
| "S C1", | |
| "n2 c(", | |
| "C2 =O", | |
| "nn 3", | |
| "o n1", | |
| "[nH] c2", | |
| "CC 5", | |
| "4) c3)", | |
| "C) CC1", | |
| "C2 CCCC", | |
| "c3ccc( Br", | |
| "=C2 C(=O)", | |
| "3CCCCC 3)", | |
| "c2ccc( O", | |
| "2 )ccc1", | |
| "(C(=O)N 3", | |
| "c3cc ncc", | |
| "CC1 CCCC", | |
| "n2 c(=O)", | |
| "N) c1", | |
| ")N C1", | |
| "CN S(=O)", | |
| "C2 CC2)", | |
| "Cn1 cn", | |
| "CC(C) (C", | |
| "C c1cccc2", | |
| "(C)C) CC1", | |
| "cc cc(", | |
| "cn c1", | |
| "[ C", | |
| "4 CCO", | |
| "n c2cccc", | |
| "[nH] c1=O", | |
| "CC c1cc", | |
| "C= C(C", | |
| "c1) C1", | |
| "F)cc (C", | |
| "CC c1", | |
| "c(C) c(C)", | |
| "C 2)n1", | |
| "CCC S(=O)", | |
| "OC) c(", | |
| "N =C(", | |
| "(C) (C)C)", | |
| "(C) O", | |
| "= CC(=O)N", | |
| "CCC1 2", | |
| "c1cccc( N", | |
| "Cc1n c(C", | |
| "= C3", | |
| "4) c3", | |
| "c2cc( N", | |
| "C3 CC3)", | |
| "NC( =S)", | |
| "C= CC1", | |
| "CCC O)", | |
| "CCCC CC", | |
| "Cc1cc( N", | |
| "c2cc s", | |
| "CC(C) CC(", | |
| "S C)", | |
| "C(C) =O)", | |
| "= [N+]", | |
| "[NH+] (C", | |
| "CO CC1", | |
| "3) c2", | |
| "c2 c(C)cc", | |
| "s 2)CC1", | |
| "CC l", | |
| "CCC2 (", | |
| ") (", | |
| "c2n n", | |
| "C c2ccc(", | |
| "=C(N) N)", | |
| "2) C(=O)", | |
| "c1cc(C 2", | |
| "(C(=O) OC", | |
| "cc1 Cl", | |
| "CO c1", | |
| "C 4)", | |
| "CCC 3)", | |
| ")cc n1", | |
| "c3cccc (C", | |
| "CC(=O)N (", | |
| "c1ccc( OC", | |
| "CCC c1n", | |
| "c3ccc s3)", | |
| "CC( N)", | |
| "cc n1", | |
| "Br )cc(", | |
| "[O-]) c(", | |
| "c2 o", | |
| "C( OC(=O)", | |
| ") NC(=O)", | |
| "2)cc1 OC", | |
| "C= CCO", | |
| ")ccc1 OC", | |
| "c2ncc cc2", | |
| "2) s1", | |
| "O=S(=O) (", | |
| "c2ccc(N 3", | |
| "4 )cc3", | |
| "[nH] c3", | |
| "(C)C) n1", | |
| "CS c1n", | |
| "C2 CCC", | |
| "C= CC", | |
| "c3n cn", | |
| "C 2)CC1", | |
| "C2 O)", | |
| "c3ccc (C)", | |
| "c(=O) o", | |
| "O=C(C 1", | |
| "[nH+] 1", | |
| ")cc2 c1", | |
| "C( OC)", | |
| "c (Cl)cc1", | |
| "[n -]", | |
| "C 2)C1", | |
| "N N", | |
| "(C(=O) O", | |
| "c1ccc s1)", | |
| "[ P", | |
| "c1ccc o1)", | |
| "O CCCO", | |
| "(F) c3)", | |
| "Cc1 o", | |
| "CC(C) n1", | |
| "C= CCn1", | |
| "cc1 C", | |
| "c4 n", | |
| "CC1 CC1", | |
| "c2n nc(C", | |
| "c(N) c1", | |
| "CCCC CCC", | |
| ")N1 CCN(", | |
| "c(N 3", | |
| "c(O) c1", | |
| "c3cc (F)", | |
| "(C) CC", | |
| "C) C1", | |
| "2)cc1 )", | |
| ")cc (C", | |
| "C3 CCCCC", | |
| "c3ccc (F)", | |
| "c(=O) c1", | |
| "c1)OCO 2", | |
| "c4 cn", | |
| "c2ccc( O)", | |
| "n 2)C1", | |
| "cc (Cl)", | |
| "c(F) c2)", | |
| "C1 (", | |
| "O S(=O)", | |
| "NC(C) =O)", | |
| "C( CC(=O)", | |
| "Cn1 cc(", | |
| "(C)cc 2)", | |
| "S1 (=O)", | |
| "c2ccc (CC", | |
| "(CC) CC", | |
| "2)c1 C", | |
| "c1n cc(", | |
| "(C)cc 3)", | |
| "CC(=O) O", | |
| "(F) c2", | |
| "4) ccc3", | |
| "ccc 5", | |
| "c1ccc(C N", | |
| "c(=O) c2", | |
| "c1cn cc(", | |
| "c2n c(C)", | |
| "[P +]", | |
| "c3 [nH]", | |
| "[n+] 1", | |
| "CCO c1ccc", | |
| "C [NH3+]", | |
| "4 CCCCC", | |
| "4 )cc3)", | |
| "C(=O)N C", | |
| "n cc(", | |
| "3) C1)", | |
| "CC (F)", | |
| "C(C) C1", | |
| "N c1cc", | |
| "[O-]) c2)", | |
| "C1 =O)", | |
| "(C) C(", | |
| "O 2)", | |
| "=N N", | |
| "CCCC 3)", | |
| "c2 c(C", | |
| "c2n ccc", | |
| "nc(C 2", | |
| "C1 (C", | |
| "c(N C", | |
| "nc2 n1", | |
| "c2s ccc2", | |
| "n 5", | |
| "= [N-]", | |
| "[S -]", | |
| "CC OC(C", | |
| "CO P(=O)", | |
| "c1ccc( n2", | |
| "( Br)", | |
| "c3cc (C", | |
| "c1 o", | |
| "=[NH+] O)", | |
| "CC1 CCN", | |
| "CC2 CCC1", | |
| ")ccc1 Cl", | |
| "C(=O)N C2", | |
| "I) c1", | |
| "c3ccc o3)", | |
| "nn n1", | |
| "CCC(C O)", | |
| "n2 c1", | |
| "nc2 1", | |
| "n3 cn", | |
| "cn n1", | |
| "n(C 2", | |
| "c4ccc (C", | |
| ") S(=O)", | |
| "cc1 2", | |
| "N c1cc(", | |
| "I )cc1", | |
| "nc1 C", | |
| "NC( N)", | |
| "cn c2", | |
| "(CC C(=O)", | |
| "n 4)", | |
| "c2cc( OC)", | |
| "2) cn1", | |
| "CC c1cccc", | |
| "Cn1 c(=O)", | |
| ")cc 2)n1", | |
| "C1 C2", | |
| "(CC) CC)", | |
| "(CC (C)C)", | |
| "C1 CCN(", | |
| "C( =N", | |
| "P (", | |
| "O=C(C O", | |
| "(F) c1)", | |
| "c2n cc(", | |
| "C= C(C)C", | |
| "NC(=O) CN", | |
| "CC c1cn", | |
| "n 2)n1", | |
| "c( [O-])", | |
| "CC1 O", | |
| "(C)cc (C)", | |
| "C(=O) OCC", | |
| "(C)cc c1", | |
| "Cc1 c(C", | |
| "S C2", | |
| ")ccc1 F", | |
| "cn 2)cc1", | |
| "c1n c2c(", | |
| "CO c1cc2", | |
| "CC2 1", | |
| "CC c1ccc", | |
| "C(F) F", | |
| "CC1 CN(", | |
| "c2n nn", | |
| "(Cl) c1)", | |
| "c4cc cc(", | |
| "CCO C(", | |
| "c(F)c1 F", | |
| "Cl) C1", | |
| "c2 C)cc1", | |
| "(Cl) c(", | |
| "CCCC (O)", | |
| "OC 4", | |
| "c1cs c(", | |
| "CC 5)", | |
| "4CCO CC4)", | |
| "CC (Cl)", | |
| "C(O) C1", | |
| "3 )cc2", | |
| "CCCC n1", | |
| "C(C S", | |
| "OC) C1", | |
| "OC(C) =O", | |
| "CC =C(", | |
| "NC(=O) OC", | |
| "CC[NH+] (", | |
| "c4ccccc 3", | |
| "3 CC4", | |
| "C= O", | |
| "C1= C(C)", | |
| "F)cc 2)c1", | |
| "CC [NH3+]", | |
| "CC c1cc(", | |
| "c 9", | |
| "O)cc 2)", | |
| ")cc 2)C1", | |
| "c1cc sc1", | |
| "ncc c1", | |
| "O [Si]", | |
| "c1n c(C)", | |
| "=[NH+] C", | |
| "c2ccc(C 3", | |
| "CCCC 2)c1", | |
| "c1 )N", | |
| "CCCC N", | |
| "(=O) C", | |
| "n c(Cl)", | |
| "- 3", | |
| "c1 c(C)cc", | |
| "Cc1cc2 c(", | |
| "C( OC2", | |
| "c4ccc5 c(", | |
| "2) c(C)c1", | |
| "[O-] )cc(", | |
| "C( CCCC", | |
| "CC1 CC1)", | |
| "cc (C(=O)", | |
| "cc2 c1", | |
| "CC1 CO", | |
| "CC2)c1 C", | |
| "N )cc1", | |
| ")ccc1 O", | |
| "C) n1", | |
| "O=C(C S", | |
| "(C) O)", | |
| "(Cl) c(C", | |
| "c1 c(N", | |
| "3) c2)", | |
| "C1 CCCC", | |
| "( OCC)", | |
| "CC1 CCN(", | |
| "c( =S)", | |
| "c(C 3", | |
| "c2n oc(C", | |
| "F)cc 4)", | |
| "C(C (C)C)", | |
| "(CCC )", | |
| "OC )cc(", | |
| "O)cc1 )", | |
| "cn1 )", | |
| "c2n [nH]", | |
| "(C) CCC", | |
| "1 )N", | |
| "c(Cl) c1)", | |
| "[O-]) n1", | |
| "C(C) =O", | |
| "c(=O) n(", | |
| "O=C(C n1", | |
| "OC )cc", | |
| "2) o1", | |
| "cc2 Cl)", | |
| "c3ccc nc3", | |
| "C( CC", | |
| "c(F) c3)", | |
| "CC c2c(", | |
| "CC(C) =", | |
| "c2n c3c(", | |
| "n3 cc", | |
| "cn 3", | |
| "O c2ccc", | |
| "o 2)CC1", | |
| "2) c(", | |
| "c(S C", | |
| "3) CC2", | |
| "C 6", | |
| "=O) C1", | |
| "ccc3 C)", | |
| "Cc1n n(", | |
| "nc( S", | |
| "O= c1", | |
| "=O) N", | |
| "s c3", | |
| "CCCO C1", | |
| "nn1 C", | |
| "CCC(C) C(", | |
| "n(C) c1", | |
| "O=C1 N", | |
| "c1ccc( S", | |
| "ncn c1", | |
| "2) N1", | |
| "F) n1", | |
| "CC= CC=", | |
| "c[nH] 1)", | |
| "CCC3 (CC", | |
| "(N) =S)", | |
| "[NH3+] )N", | |
| "e ]", | |
| "(=O) [nH]", | |
| "c1n n", | |
| "ncc 3", | |
| "(C c2ccc", | |
| "OCC 3", | |
| "s c(", | |
| "CCC1 )", | |
| "7 )", | |
| "cccc 3", | |
| "c5ccc 6", | |
| "CCC N2", | |
| "3) ccc2", | |
| "c2 =O)cc1", | |
| "C= CC(", | |
| "(C)C (C", | |
| "n2 cc(", | |
| "2) C2", | |
| "n2 nn", | |
| "C= CCN", | |
| ")N1 CCC(", | |
| "ccc n1", | |
| "CC1 CC(", | |
| "3CCCCC 3", | |
| "C [Si](C)", | |
| "Cn1 cc(C", | |
| "n2 n", | |
| "nn c2", | |
| "3)C2 )cc1", | |
| "nc1 N", | |
| "CC1 CCC(", | |
| "(C(=O)N 1", | |
| "B (O)", | |
| "CO C(=O)N", | |
| "CC3 )cc2", | |
| "N =N", | |
| "c5 cccc", | |
| "c1cc( N2", | |
| "ccccc 5", | |
| "(CC (O)", | |
| "4) C3", | |
| "cn 2)CC1", | |
| "3 CCC", | |
| "CO C(", | |
| "c1c( N)", | |
| "H ]", | |
| "(=O) o", | |
| "c2cn cc", | |
| "c -2", | |
| "C [NH3+])", | |
| "ccccc 8", | |
| "3) C2)", | |
| "CCC2 C3", | |
| "(=O) [O-]", | |
| "F)cc1 Cl", | |
| "CCCCC O", | |
| ")cc 5", | |
| "CC1 CCCC1", | |
| "CO CCC", | |
| "3 C(=O)", | |
| "N c1ccc", | |
| "OCO 4)", | |
| "CCC l)", | |
| "C(C c1cn", | |
| "c3ccc s", | |
| "c2s c(", | |
| "(CC (C)", | |
| "CCO CC2", | |
| "O= c1[nH]", | |
| "O c2ccccc", | |
| "CCCN (C", | |
| "c1ccc(C (", | |
| "C(F) F)", | |
| "c1) OCCO2", | |
| "c(Cl)cc 2", | |
| "s c1C", | |
| ")cc1 2", | |
| "c6 ccc", | |
| "c2cs c(", | |
| "c2cc( N)", | |
| "c4 c3", | |
| "c3 cs", | |
| "(CC l)", | |
| "c(C) cc1", | |
| "N# C", | |
| "C(O) C1O", | |
| "c2cn n(C)", | |
| "c2) OCCO", | |
| "c2)OCO 3)", | |
| "C(C 2", | |
| "F)cc 4", | |
| "4 CC4)", | |
| "c5 cc", | |
| "c3c( c2", | |
| "Cn1 cc", | |
| "CC2 CCCO", | |
| "C(C)C) c1", | |
| "[C -]", | |
| "Cc1 c(C)", | |
| "(=O) c1cc", | |
| "c1ccc( O)", | |
| "c2cc o", | |
| "[O-]) c2", | |
| ")cc1 )", | |
| "CC1 CCC(C", | |
| "c(C) c3)", | |
| "cc 5", | |
| "(C) c2", | |
| "ccc2 n1", | |
| "OC(F) F", | |
| "CCCC (C)C", | |
| "C OC(C", | |
| "[O-]) c3)", | |
| "[N+] 1", | |
| "n2 C", | |
| "Cc1cc( N2", | |
| "C NC(=O)N", | |
| "C(C)C 2", | |
| "CCCO 1)", | |
| "Cc1ccc( O", | |
| "CC(C) c1n", | |
| "n(C) n1", | |
| "CO CCn1", | |
| "C(C) CC", | |
| "Br )cc2", | |
| "Cl )N", | |
| "c1s ccc1", | |
| "(C)cc 3", | |
| "CC( =N", | |
| "C2 CCCCC", | |
| "c4cccc 5", | |
| "C) C(=O)", | |
| "S C(=C", | |
| "(C 3", | |
| "c(=O) n3", | |
| "CC(C #N)", | |
| "c(F) c2", | |
| "C1 CCC(", | |
| "(C) CC2", | |
| "C= C2", | |
| "2) N", | |
| "cc1 Cl)", | |
| "c1cn c(", | |
| "c1C #N", | |
| "N1 CCCC1", | |
| "=O) CC1", | |
| "CC(C) (", | |
| "CCCCC =", | |
| "2)cc1 C", | |
| "( c2ccc(", | |
| "(CCCC )", | |
| "C(C 1", | |
| "4) C2)", | |
| "c1 c(Cl)", | |
| "c(C (C)C)", | |
| "n2 C)", | |
| "CC c2ccc(", | |
| "CO CCN", | |
| "OC c1ccc(", | |
| "c(=O) n(C", | |
| "N (C)C", | |
| "3)C1) C2", | |
| "C( Br)", | |
| "c1n c(N)", | |
| "Br) c2)", | |
| "c(C) c(", | |
| "ccc2 Cl)", | |
| "nc2 s", | |
| "[nH] 3)", | |
| "CS CCC(", | |
| "c8 ccccc8", | |
| "CCC (C)C)", | |
| "CCCCC )", | |
| "(C) c(", | |
| "CO 1", | |
| "= NC(=O)", | |
| "OC) C(=O)", | |
| "CCCC CC)", | |
| "O) C(O)", | |
| "c2c( c1)", | |
| "n2 nc(", | |
| "c( F)cc2", | |
| "C2 CC3", | |
| "3)n 2)", | |
| "# [N+]", | |
| "c(C)c1 C", | |
| "Cc1cc sc1", | |
| "O 1)", | |
| "C2 CCCCC2", | |
| "s 2)C1", | |
| "F)cc cc3", | |
| "c(=O) n", | |
| "C1 CC", | |
| "[NH3+] C(", | |
| "C2 =O)c1", | |
| "(Cl) s1", | |
| "[n+] 2", | |
| "[O-] )cc3", | |
| "CC( S", | |
| "Cc1ccc o1", | |
| ")N1 CCCC1", | |
| "cc2 C)", | |
| "C(C) O)", | |
| "C1 (C)", | |
| "(C NC(=O)", | |
| "C1 CC1)", | |
| "O 3)", | |
| "CO c1c(", | |
| "Cc1n c(N", | |
| "( c2ccc", | |
| "N1 CCN", | |
| "(CC [NH+]", | |
| "(C) (C)C", | |
| "c1n c(Cl)", | |
| "c2cc (O)", | |
| "cs 2)cc1", | |
| "c2n oc(", | |
| "c1cc( O)", | |
| "nc2 )cc1", | |
| "ccccc2 3)", | |
| "2)CC1 )", | |
| "N1 CCN(", | |
| "(=O)N C", | |
| "O=C(C =C", | |
| "OC) c(C", | |
| "OC(F) F)", | |
| "n c4)", | |
| "c1cn n(", | |
| "(C) cc1", | |
| "S 2", | |
| "c1n c(C2", | |
| "c(C) c2)", | |
| "C1 =C(", | |
| "C OC(C)", | |
| "c3ccc( O", | |
| "CCC(C 2", | |
| ")ccc1 2", | |
| "ncn 2", | |
| "c1cn cc", | |
| "c3) OCO4)", | |
| "N2 CCN", | |
| "CC1 CC", | |
| "CC(C) N", | |
| "s 2)n1", | |
| "(=O)N (C)", | |
| "Nc1n cn", | |
| "c2cn 3", | |
| "(Cl) c3", | |
| "CCC1 CCCC", | |
| "CC( =C", | |
| "O c1ccc(C", | |
| "CC(O) C1", | |
| "= CN", | |
| "(=O)N C2", | |
| "[O-]) C(", | |
| "CCC OC", | |
| "(C)C) C2", | |
| "2)cc1 Cl", | |
| ")N c1ccc(", | |
| "c1n [nH]", | |
| ")ccc1 N", | |
| "cc( S(=O)", | |
| "CCO CC", | |
| "cn 2)c1", | |
| "c4cc 5", | |
| "3CCO CC3", | |
| "(C) =O)", | |
| "n nc(", | |
| "c2c( c1", | |
| "CN2 C(=O)", | |
| "C1 CC2", | |
| "2) C(=O)N", | |
| "NC( N", | |
| "c1ncc s1", | |
| "c2 C1", | |
| "cccc c12)", | |
| "CCc1n c(", | |
| "nn nc1", | |
| "c2c1 C", | |
| "3)n 2)c1", | |
| "c5 c(", | |
| "=C(N) N", | |
| "2) C(", | |
| "cn 3)", | |
| "CCC #N)", | |
| "c1ccc( N)", | |
| "c1n cc(C", | |
| "c3ccc o", | |
| "C2 C3", | |
| "c2n o", | |
| "c2C) CC1", | |
| "c1n o", | |
| "c2 c(Cl)", | |
| "Br) C1", | |
| "= CC2", | |
| "(C) n1", | |
| "= CC", | |
| "CCn1 cn", | |
| "CCCCC (", | |
| "OCC1 OC(", | |
| "cs1 )", | |
| "[O-]) C2", | |
| "=C (Cl)", | |
| "= CC1", | |
| "o c(=O)", | |
| "O c1ccc", | |
| "C( =S)", | |
| "C= CCCC", | |
| "cc1 )", | |
| "c3 =O)", | |
| "[nH] 2)c1", | |
| "(C 1", | |
| "(C) c3)", | |
| "c(F) c1)", | |
| "C= CC(C", | |
| "ccc( N", | |
| "C(=O) OC1", | |
| "CC) c1", | |
| "C12 CC3", | |
| "CCC (C(C)", | |
| "Cc1n nc(", | |
| "[O-]) c1)", | |
| "O=C(N CC1", | |
| "CCS C1", | |
| "c2)cc1 OC", | |
| "s 4)", | |
| "c2cc nc(N", | |
| "C(=O) C3", | |
| "c6 )", | |
| "(C (N)=O)", | |
| "[NH3+]) C", | |
| "= N)", | |
| "(CC CCC", | |
| "3)C2 =O)", | |
| "2) n", | |
| "CC OC(C)", | |
| "C(N) =S", | |
| "ccc3 Cl)", | |
| "ccccc3 4)", | |
| "CCCC CCO", | |
| "CC(=O) OC", | |
| "Cn1 ccnc1", | |
| "3 CC[NH+]", | |
| "(=O) O", | |
| "C2 1", | |
| "O=C( CC", | |
| "CCCCC 3", | |
| "F)cc 2)n1", | |
| "c2cc ncc2", | |
| "C1 (C)C", | |
| "C(= C)", | |
| "c2 c(N", | |
| "n2 n1", | |
| "c1cn c(N", | |
| "OCC) c1", | |
| "c(C O", | |
| "c1cn 2", | |
| "CC1 CCCO1", | |
| "n c2)c1", | |
| "c1 [nH+]", | |
| "c( F)cc1", | |
| "CC(O) CO", | |
| "ccc2 F)", | |
| "c3cc4 c(", | |
| "CC OC3", | |
| "(C c2ccc(", | |
| "c(C O)", | |
| "c2n c(=O)", | |
| "cc1 F", | |
| "C(=O)N CC", | |
| "n2 nc(C)", | |
| ")ccc1 Br", | |
| "N1 CCC(", | |
| "c4) CC3)", | |
| "c2n c(N)", | |
| "CO CCN1", | |
| "F)ccc1 F", | |
| "=[N-] )", | |
| "C3 )cc1", | |
| "c1ccc(C O", | |
| "c(C) c2", | |
| "cc( O)", | |
| "Cl) n1", | |
| "3) c2)cc1", | |
| "n c5", | |
| "c2C) c1", | |
| "O=C( CC1", | |
| "C(C) S", | |
| "( CCO", | |
| "N C1=O", | |
| "c2n cc(C", | |
| "#N) c1", | |
| "C1 CCCN", | |
| "c2n (", | |
| "N1 CC", | |
| "C(O) =C(", | |
| "Cc1n n", | |
| "N c1", | |
| "S C(C)", | |
| "CCC1 (C", | |
| "OCO 2", | |
| "CCCC CC=", | |
| "CC# CC#", | |
| "c1cc( N)", | |
| "F)cc2 F)", | |
| "2 )cc(", | |
| "(C)C (C)C", | |
| "cs 2)", | |
| "c3cc( OC)", | |
| "CCC2 1", | |
| "c1 =O)", | |
| "(CC OC)", | |
| "c2 3)", | |
| "C(=O) OC)", | |
| "(C)C )cc2", | |
| "c2n c3", | |
| "O O", | |
| "c2nnn n2", | |
| "3 )cc2)", | |
| "= CCCC", | |
| "(Cl)c1 Cl", | |
| "N# Cc1", | |
| "c(C N", | |
| "c oc(", | |
| "(C(C) (C)", | |
| "OC c1ccc", | |
| "C= CC2", | |
| "%1 0", | |
| "O=C(N C", | |
| "NC(=O)N (", | |
| "c4 ncc", | |
| "=C( S", | |
| "CCO P(=O)", | |
| "Cc1cs c(", | |
| "CC(C) O1", | |
| ")cc (C)c1", | |
| "c1ccc( N(", | |
| "CS C1", | |
| "CC2) nc1", | |
| "c4 )cc3", | |
| "c1cc (=O)", | |
| "N= [N+]", | |
| "C( c1ccc(", | |
| ")cc 5)", | |
| "(C(=O) C3", | |
| "N1 CCOCC1", | |
| "C c2cccc", | |
| "CC2 (", | |
| "nn (C)", | |
| "n2 cc(C", | |
| "c1n n(", | |
| "CCC1 (CC)", | |
| "C( O", | |
| "n 3)n", | |
| "o 2)C1", | |
| "Cl) C(=O)", | |
| "n3 ccc", | |
| "(C) c2)", | |
| "c( Br)cc1", | |
| "n2 c(C)", | |
| "Br) s1", | |
| "CC(O) (C", | |
| "C1 CC(", | |
| "nc(C) n1", | |
| "c6 ccc(", | |
| "C(C) (C", | |
| "F)cc 2)C1", | |
| "F) C(=O)", | |
| ")N1 CC", | |
| "(Cl) (Cl)", | |
| "c1cccc( O", | |
| "=O) cc2", | |
| "CC )cc1", | |
| "4 C)", | |
| "CC2 (CC", | |
| "c1 co", | |
| "C1 CCC2", | |
| "c2c( N)", | |
| "c2ccs c2)", | |
| "(Cl)cc 4)", | |
| "C[NH2+] 1", | |
| "c[nH] 1", | |
| "CCC 5", | |
| "c(=O) c3", | |
| "c1cc( OC", | |
| "CCCC CCC1", | |
| "c4 c3)", | |
| "CCO 2", | |
| "[NH2+] 1)", | |
| "C[NH2+] C", | |
| "c1 c[nH+]", | |
| "Br)cc1 )", | |
| "CCCCC (C)", | |
| "ccc2 C)", | |
| "CCn1 c(", | |
| "(C(=O) CC", | |
| "CN( S(=O)", | |
| "c(F) c3", | |
| "CC2 CCC", | |
| "= CC(", | |
| "N2 CC", | |
| "=[NH+] O", | |
| "cc c12", | |
| "C2 C1", | |
| "Cc1n c(C)", | |
| "(C(=O) CS", | |
| "OC) n1", | |
| "2)c1 =O", | |
| "c%1 0", | |
| "CO CC(C)", | |
| "3) CC2)c1", | |
| "c(N C2", | |
| "c3ccc( O)", | |
| "NC(=O)N C", | |
| "- c2ccc(", | |
| "n2 nc(C", | |
| "c2cc (=O)", | |
| "CCC( N)", | |
| "CCn1 c(S", | |
| "ncn c3", | |
| "CCC l", | |
| "c1n nc(C", | |
| "( c4ccccc", | |
| "F c1ccc(", | |
| "c3cc( Br)", | |
| "= Cc1ccc(", | |
| "c2n c(Cl)", | |
| "CCS 1", | |
| "C OC2", | |
| "S CC(=O)", | |
| "c2 [nH+]", | |
| "C(C) (O)", | |
| "COc1cc( N", | |
| "n2cc nc2)", | |
| "(C)C) c(", | |
| "2)c1 )", | |
| "(F) c3", | |
| "(F)(F) F", | |
| "CCC 4)", | |
| "c(Cl) c2", | |
| "[nH] n1", | |
| "n2 c(C", | |
| "(C2 CC2)", | |
| "C= CCC1", | |
| "N= C1", | |
| "OC1 2", | |
| "C4 CCCCC", | |
| "(=O) C2", | |
| "CCCC 2)C1", | |
| "OC) CC1", | |
| "O=C(N CC", | |
| "nc2 c(", | |
| "S1(=O) =O", | |
| "N# CC1", | |
| "O c3ccc(", | |
| "C(=O) C(C", | |
| "C3 O)", | |
| "F)cc1 )N", | |
| "CC2 (O)", | |
| "c3cc 2", | |
| "cn n1C", | |
| "nn 2)cc1", | |
| "Cc1ccc s1", | |
| "2) no1", | |
| "CC2 C1", | |
| ") C2", | |
| "O CC[NH+]", | |
| "S C(", | |
| "3 CCN(", | |
| "CCCC 4)", | |
| "CCC(C #N)", | |
| "O CC(", | |
| "(C(=O) CO", | |
| "n(C) c1=O", | |
| "[S e]", | |
| "c4ccc( OC", | |
| "F)cc3 F)", | |
| "n (CC)", | |
| "[S-] )", | |
| "3) C(=O)", | |
| "N# Cc1cc(", | |
| "CCCN C(N)", | |
| "2) nn1", | |
| "c(Cl)cc (", | |
| "Cc1cc nc(", | |
| "C(C) N", | |
| "o c1C", | |
| "cc1 OC)", | |
| "4) CC3", | |
| "c3ncc cc3", | |
| "cn c3", | |
| "CCC1 (C)", | |
| "c1c( O)", | |
| "Cc1n n(C", | |
| "CCC(C 1)", | |
| "c3 c[nH]", | |
| "(Cl)cc 4", | |
| "CCO c1cc", | |
| "CC( Br)", | |
| "CN( CC1", | |
| "c4cc (F)", | |
| "Cc1 c(N", | |
| "Cc1cc (F)", | |
| "C(C) CC)", | |
| "c3 o", | |
| "c2 c[nH+]", | |
| "[O-]) N", | |
| "OC) c2)", | |
| "C2 CCC1", | |
| "3) nc2", | |
| "Cc1ccc( S", | |
| "=O) ccc1", | |
| ")cc cc2", | |
| "CCS CC1", | |
| "N (C)C)", | |
| "c3n ccc", | |
| ")cc3) C2", | |
| "OC)cc1 )", | |
| "3) n1", | |
| "CC1 =N", | |
| "CC(C 1", | |
| "n1 cc", | |
| "2 CCN(", | |
| "CC (CC)", | |
| "(N N)", | |
| "(C) CC2)", | |
| "F)cc1 F)", | |
| "Br)cc (C", | |
| "Cn1 c(", | |
| "2)cc1 F", | |
| "Cc1n c(C2", | |
| "c1cc nc(N", | |
| "OCC (C)C)", | |
| "(C)C )cc(", | |
| "cs c1", | |
| "3) c(", | |
| "S S", | |
| "c2 c3c(", | |
| "CCCC 2)n1", | |
| "C# CCO", | |
| "c1cc oc1", | |
| "C(O) C2", | |
| "4 CC[NH+]", | |
| "(C) CC3)", | |
| "CC1 CCCC(", | |
| "c1 [nH]c(", | |
| "(F)c1 F", | |
| ")N (", | |
| "c1n c(=O)", | |
| "c2c( O)", | |
| "c2n n(", | |
| "CCC(C) C1", | |
| "2 C(", | |
| "C 3)n", | |
| "cn n2", | |
| "2) C(C)", | |
| "CC4 )cc3", | |
| "n o2)", | |
| "C2 (", | |
| "[O-]) cn1", | |
| "=C (C)C", | |
| "n 6", | |
| "c1n oc(", | |
| "c2cn n(", | |
| ")N1 CCN", | |
| "N2 CCCC2", | |
| ")cc (=O)", | |
| "o 2)n1", | |
| "OC) c3)", | |
| "c5 cc(", | |
| "c1 O", | |
| "Cc1 c[nH]", | |
| "OCC (C)C", | |
| "2 CC[NH+]", | |
| "O= S1(=O)", | |
| "C(C) (", | |
| "[Si] (", | |
| "c2cc1 OC", | |
| "c(C) s1", | |
| "c[nH+] 1", | |
| ")cc 3)n", | |
| ") C", | |
| "c -3", | |
| "CC2 (C", | |
| ")ccc1 C", | |
| "N3 C(=O)", | |
| "N c1cn", | |
| "CC1 CN", | |
| "Br) c1)", | |
| "CC4 )cc3)", | |
| "OC) c2", | |
| "3 CCN", | |
| "C1 (O)", | |
| "nn (", | |
| "=O)cc 2)", | |
| "(C) CCO", | |
| "c4 nc(", | |
| "c(N S(=O)", | |
| "c2nn [n-]", | |
| "ccc 6", | |
| "c3n nc(", | |
| "c2cn c(N", | |
| "c o1", | |
| "4) C3)", | |
| "c(C [NH+]", | |
| "CCn1 cc", | |
| ")cc1 F", | |
| "c2n nc3", | |
| "OCC O)", | |
| "3) n2", | |
| "n2cc nc2", | |
| "c2cn (C)", | |
| "c1ncn 2", | |
| "C1 CCC1", | |
| "#N )cc2", | |
| "c2cc nn2", | |
| "N1 S(=O)", | |
| "[C H]", | |
| "C2 CC2)c1", | |
| "CCC12 C", | |
| "c6ccc 7", | |
| "n o1)", | |
| "C2 (C)", | |
| "Nc1n c(", | |
| "2 CC3", | |
| "c2 co", | |
| "c1cc s", | |
| "CC2) cn1", | |
| "c1cs c(C", | |
| "C(C) =", | |
| "CCCN (CCC", | |
| "c(N) n", | |
| "Cc1 c(Cl)", | |
| "o c2c1", | |
| "F)cc 3)n", | |
| "c1) C(", | |
| "CC1 CC2", | |
| "C2 CCN", | |
| "c(N) n1", | |
| ") C(C)C", | |
| "(CC =C)", | |
| "CO CC(", | |
| "C(O) C(", | |
| "c2ccc( I", | |
| "[O-]) c(N", | |
| "c1) CCC2", | |
| "c(OC) c3)", | |
| ") C(", | |
| "2) O1", | |
| "c2cn [nH]", | |
| "CCn1 cc(", | |
| "C= CCN1", | |
| "c1) OCCO", | |
| "C) CC3)", | |
| "CCC1 =O", | |
| "OCCO 4)", | |
| "CN c1n", | |
| "(CC 3", | |
| "s c(N", | |
| "2) cs1", | |
| "C1 (C(=O)", | |
| "CCC1 O", | |
| "(C)C )cc3", | |
| "c1cc nc(", | |
| "= N1", | |
| "Cn1 nccc1", | |
| "C1 =N", | |
| "O=C( OC", | |
| "c1c( Br)", | |
| "c4ccc( N", | |
| "c3ccc( n4", | |
| "c1s c(", | |
| "CO c1c(C)", | |
| "CS c1ccc(", | |
| "c1ccc2 n", | |
| "3)CC2) n1", | |
| "CC(O) C(", | |
| "c2ccc( N)", | |
| "c4cc ncc", | |
| "CCn1 cc(C", | |
| "C1 =C", | |
| "[O-]) s1", | |
| "(=O) CC1", | |
| "(CC N", | |
| "n3 C)", | |
| "c2cc n", | |
| "CC(C)C n1", | |
| "c1cc n", | |
| ")cc( N", | |
| "2 CCC", | |
| "ccc2 o1", | |
| "CO c1cn", | |
| "c(=O) c(", | |
| "Cc1n cc", | |
| "OC 5", | |
| "c4ccc o", | |
| "O c2ccc(C", | |
| "(=O)N CC", | |
| "CC3 CCC2", | |
| "CCO c1cc(", | |
| "Nc1n c(N", | |
| "o c2", | |
| "CC2) s1", | |
| "nn 2)", | |
| "[NH2+] C3", | |
| "cc2 c(", | |
| "Cn1 nc(", | |
| "cc2 F)", | |
| "n2cn c3", | |
| "CCCC N(", | |
| "c1)OCO 2)", | |
| "(C c2cccc", | |
| "C( c2ccc", | |
| "CC2)cc1 C", | |
| "c3ccc(C 4", | |
| "C2 CCCC2", | |
| "CC( OC)", | |
| "c(C =O)", | |
| "C(C#N) =C", | |
| "CC c1c(C)", | |
| "N c1cccc(", | |
| "- 4", | |
| "c2ccc( n3", | |
| "Br) c2", | |
| "CC1 CCCN", | |
| "c3cc s", | |
| "Br) CC1", | |
| ") [NH+]1", | |
| "[O-]) cn", | |
| "C#N )cc1", | |
| "c( I)", | |
| "F)cc2 1", | |
| "c(C#N) c1", | |
| "C[NH+] (", | |
| "[NH+]2 CC", | |
| "c3 )cc2", | |
| "c2cn c(", | |
| "cc (F)", | |
| "c2) cn1", | |
| "c(OC )cc2", | |
| "C2 (C)C", | |
| "N1 CCCCC1", | |
| "CC(C)C (C", | |
| "B (", | |
| "CC(=O)N C", | |
| "=S )N1", | |
| "cc cc2", | |
| "O) C1", | |
| "F)cc (F)", | |
| "c3 4)", | |
| "C= CCC", | |
| "(C) c(C", | |
| "N1 C", | |
| "c1ccc(N C", | |
| "(C(=O) C(", | |
| "Cc1cn 2", | |
| "c(C) cc2", | |
| "O) ccc1", | |
| "c(C) o1", | |
| ") c1ccc", | |
| "c1cn n2", | |
| "CC3 )cc2)", | |
| "C= C=", | |
| ")N (C)", | |
| "O P", | |
| "[NH+] (CC", | |
| "C1 CO", | |
| "C2 C", | |
| "CC #N)", | |
| "[O-]) c(C", | |
| "( =S)", | |
| "CCCC( N", | |
| "F C(F)", | |
| "Cc1n ccn1", | |
| "CC c2cc(", | |
| "3 c(", | |
| "ccc nc2", | |
| "CCC1 C", | |
| "S c2n", | |
| "C= C(C#N)", | |
| "CO c1n", | |
| "O) CC1", | |
| "[nH] c(C", | |
| ")N (C)C", | |
| "5) ccc4", | |
| "4)C2) C3)", | |
| ")cc1 Cl", | |
| "Br) c(", | |
| "(F) F", | |
| "cc1 F)", | |
| "4CCCCC 4)", | |
| "C =O)", | |
| "5 )cc4", | |
| "OC1 (C)C", | |
| "5) c4", | |
| "C c3ccccc", | |
| "CC c2ccc", | |
| "c1ccc(C #", | |
| ")cc1 C", | |
| "O=C( CCC" | |
| ] | |
| } | |
| } |