RDKit 3D 42 45 0 0 0 0 0 0 0 0999 V2000 4.5124 -1.5962 -0.7072 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1592 -1.1718 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7087 0.1071 -0.5997 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6363 0.2993 0.1039 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5472 -0.6405 0.4796 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7761 0.0154 0.6264 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3985 -0.4634 1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6875 -0.5542 -0.4699 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4606 -2.0243 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1238 -0.3244 -0.0747 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9150 -0.8549 -1.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3519 1.1241 0.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1704 1.9833 0.2518 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.6864 2.1245 1.6095 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8849 1.4713 0.5703 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2987 2.2566 0.0875 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6072 1.6980 0.5694 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7011 2.3065 -0.0279 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4275 1.3624 -0.7122 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5078 1.5868 -1.3101 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8478 -2.4485 -1.3357 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4709 -1.9204 0.3444 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2647 -0.7911 -0.8528 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4362 -1.9788 -1.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3006 -0.9857 -2.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5423 -1.4574 -0.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8661 -1.1100 1.4347 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7091 -1.5120 1.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5713 -0.3790 2.7101 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 0.2330 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4904 0.0593 -1.3716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4612 -2.4870 -0.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1012 -2.5612 0.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8357 -2.1553 -1.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3554 -0.9530 0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6442 -1.4209 -0.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9936 1.2357 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0247 1.4920 -0.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2633 3.0070 -0.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2068 3.2888 0.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3216 2.3503 -1.0155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7261 1.7889 1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 1 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 15 14 1 1 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 3 1 0 17 4 1 0 15 6 1 0 15 13 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 5 26 1 0 5 27 1 0 7 28 1 0 7 29 1 0 7 30 1 0 8 31 1 6 9 32 1 0 9 33 1 0 9 34 1 0 10 35 1 1 11 36 1 0 12 37 1 0 12 38 1 0 13 39 1 6 16 40 1 0 16 41 1 0 17 42 1 1 M END