RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 -4.5397 2.2000 -1.9678 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 1.0274 -1.6687 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1141 -0.0838 -1.3902 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2878 1.1558 -1.6964 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1851 0.3915 -1.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8805 -0.1361 -0.1182 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9711 -0.9935 0.3999 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4429 -2.0095 1.4283 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -2.9820 0.6842 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5983 -2.1414 0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9424 -2.8011 0.1259 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4375 -0.8982 -0.1554 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6641 -0.1441 -0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.1775 0.0074 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7475 1.1949 1.2057 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7062 1.0370 0.8402 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0634 2.4817 1.7332 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4315 2.7021 1.5296 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0509 3.6628 2.0353 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 1.6230 0.6436 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6136 0.6098 1.5017 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1352 3.1009 -1.4483 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5728 2.3194 -3.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 1.9819 -1.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3135 -0.5196 -2.2053 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2633 0.8458 -1.9605 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8091 -0.5023 0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4005 -1.6829 -0.3885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8098 -1.4434 2.1241 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2887 -2.4948 1.8933 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -3.7281 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0486 -3.4334 -0.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8895 -3.8703 0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3762 -2.7241 -0.9029 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -2.3445 0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6026 -0.0525 -1.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5231 -0.7698 -0.4258 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4121 1.9696 -0.7263 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0482 0.3772 1.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0567 1.9917 0.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2618 0.8566 1.7781 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 2.0413 -0.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4538 0.1496 0.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.0635 2.3894 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0005 -0.2057 1.8625 H 0 0 0 0 0 0 0 0 0 0 0 0 21 20 1 0 20 14 1 0 14 13 1 0 13 12 1 0 12 10 2 0 10 11 1 0 10 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 6 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 6 16 1 0 16 15 1 0 15 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 15 14 1 0 6 12 1 0 21 43 1 0 21 44 1 0 21 45 1 0 20 42 1 6 14 38 1 6 13 36 1 0 13 37 1 0 11 33 1 0 11 34 1 0 11 35 1 0 9 31 1 0 9 32 1 0 8 29 1 0 8 30 1 0 7 27 1 0 7 28 1 0 5 25 1 0 5 26 1 0 1 22 1 0 1 23 1 0 1 24 1 0 16 40 1 0 16 41 1 0 15 39 1 1 M END