RDKit 3D 57 61 0 0 0 0 0 0 0 0999 V2000 -0.8543 2.6446 2.6526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0291 1.6957 2.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3504 0.8833 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6179 1.0159 0.4868 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5003 1.9740 1.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1194 2.7830 2.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0937 0.1301 -0.6600 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0045 -0.2885 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4102 0.8812 -2.3357 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0869 0.7069 -3.0829 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 1.8318 -3.9762 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1807 -0.6633 -3.5352 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1876 0.9437 -1.7169 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3489 2.2258 -1.1827 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1555 2.4019 -0.0582 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8154 1.3085 0.5064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 0.0336 -0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8493 -0.1544 -1.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1964 -1.0945 0.5151 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6257 -1.0591 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1504 -0.2605 1.7315 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 1.2265 1.5517 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4965 1.5379 1.6697 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8151 -1.0860 -0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0506 -1.5129 -0.4225 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0877 -1.0660 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2321 -1.7686 -1.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4413 -2.9601 -0.5372 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5192 -3.4473 0.3121 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2450 -2.7200 0.4067 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2314 -2.9870 1.1331 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.1750 -1.9852 0.9142 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 3.2826 3.4802 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0232 1.5962 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3753 0.1598 0.7158 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 2.1096 0.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8064 3.5302 2.4808 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8124 0.7342 -1.2331 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4643 -0.9112 -2.4598 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2316 -0.8916 -1.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0029 1.5621 -2.8114 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8313 3.0791 -1.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2587 3.3880 0.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7237 -1.1523 -1.5741 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9551 -2.0989 0.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0357 -0.6995 -0.4056 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6612 -0.6079 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2289 -0.4253 1.8273 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3002 1.6073 0.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3926 1.7717 2.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9536 -0.1800 -1.9113 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0443 -1.4591 -2.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4034 -3.4586 -0.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7029 -4.3366 0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2024 -3.7813 1.7692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2869 -2.4997 0.5391 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9847 -1.4899 1.8689 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 4 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 2 0 10 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 7 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 6 1 1 0 18 13 1 0 23 16 1 0 32 24 1 0 30 25 1 0 1 33 1 0 2 34 1 0 3 35 1 0 5 36 1 0 6 37 1 0 7 38 1 6 8 39 1 0 8 40 1 0 9 41 1 0 14 42 1 0 15 43 1 0 18 44 1 0 20 45 1 0 20 46 1 0 21 47 1 0 21 48 1 0 22 49 1 0 22 50 1 0 26 51 1 0 27 52 1 0 28 53 1 0 29 54 1 0 31 55 1 0 32 56 1 0 32 57 1 0 M CHG 1 31 1 M END