B1AID4 -OEChem-04022105322D 63 66 0 1 0 0 0 0 0999 V2000 9.7142 2.8359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 -0.7126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3931 -0.1636 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2591 -0.6636 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1251 -0.1636 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4831 -0.6705 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1251 0.8364 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4750 -1.7121 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3931 0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2591 1.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2752 -1.7051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0713 1.1411 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0713 -0.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3771 -2.2329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5562 -0.1064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6550 0.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5396 -2.2618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4908 0.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1251 1.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6084 -0.6343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -1.7193 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3820 2.0916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3605 2.2979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 0.2614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9985 -1.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2151 -1.0088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4783 -2.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 1.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7825 0.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6576 1.8113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8606 1.8113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4932 -2.2855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8843 -1.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6339 1.5805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8203 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6087 -0.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9798 -2.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7781 -2.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9644 0.3603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1663 0.3757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1158 -0.0783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1158 0.7511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1423 -2.7378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9406 -2.7347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1108 0.3247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4956 0.9495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8708 0.3343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7451 1.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1251 2.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5051 1.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4038 -0.0490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9967 -0.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0648 -1.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7296 -2.8359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4884 1.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9672 2.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2327 2.9045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 -1.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -2.5172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 -2.7474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 25 2 0 0 0 0 22 3 1 1 0 0 0 3 25 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 27 1 6 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 28 1 1 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 6 29 1 6 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 19 1 1 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 20 1 1 0 0 0 9 15 1 0 0 0 0 9 18 1 0 0 0 0 9 30 1 6 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 15 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 17 1 0 0 0 0 13 23 1 1 0 0 0 13 37 1 0 0 0 0 14 17 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 21 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 22 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 M END $$$$