RDKit 3D 50 53 0 0 0 0 0 0 0 0999 V2000 6.8540 -0.8792 0.5615 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3692 -0.7895 0.7435 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5338 -0.5653 -0.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1487 -0.4611 -0.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5774 -0.5875 1.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4163 -0.7832 2.1838 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8011 -0.8828 2.0188 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1196 -0.4184 1.3243 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 0.0076 2.4218 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1194 -0.6555 0.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0796 -1.6634 -0.6324 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2152 -1.4058 -1.3991 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6498 -2.0429 -2.3476 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8497 -0.3197 -0.8154 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0492 0.2639 0.2303 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7310 1.7070 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5004 2.7763 0.8061 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2248 3.8937 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2994 3.4430 -1.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6082 2.1187 -1.3372 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1081 4.0812 -2.6318 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1688 0.1605 -1.1958 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3896 -0.5366 -0.5499 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3294 -0.7922 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7549 -2.1841 1.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2217 -2.8452 -0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6568 -1.8158 -1.1443 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8006 -2.6669 -0.8772 O 0 0 0 0 0 1 0 0 0 0 0 0 7.3043 -1.5188 1.3279 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 0.1180 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1028 -1.3154 -0.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -0.4857 -1.3602 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5238 -0.3028 -1.0677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9861 -0.8636 3.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4275 -1.0419 2.8922 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6085 0.1868 1.1681 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5097 2.7331 1.8868 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0141 4.8990 0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0157 3.9919 -3.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1248 5.1448 -2.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7162 3.6057 -3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2485 0.0469 -2.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2182 1.2314 -0.9723 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2597 0.0918 -0.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3518 -0.8142 1.3432 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7808 -0.0378 1.5111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6623 -2.1585 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0881 -2.7247 1.9281 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0764 -3.5036 -0.0589 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4336 -3.4391 -0.7162 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 5 8 1 0 8 9 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 19 21 1 0 14 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 11 28 1 0 7 2 1 0 15 10 1 0 20 16 1 0 27 23 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 4 33 1 0 6 34 1 0 7 35 1 0 15 36 1 1 17 37 1 0 18 38 1 0 21 39 1 0 21 40 1 0 21 41 1 0 22 42 1 0 22 43 1 0 23 44 1 1 24 45 1 0 24 46 1 0 25 47 1 0 25 48 1 0 26 49 1 0 26 50 1 0 M CHG 1 28 -1 M END