RDKit 3D 53 56 0 0 0 0 0 0 0 0999 V2000 -4.7219 -0.0993 -1.9103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7949 -0.3310 -1.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6298 -1.2609 -1.1299 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7189 -0.7711 0.0069 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7445 -0.5571 1.0916 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7437 0.3071 0.3426 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0987 1.6711 0.2909 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7996 1.7061 -0.4301 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0257 0.4373 -0.4773 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3871 0.6055 0.1198 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2775 0.9087 1.5867 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1226 1.7205 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1545 1.2482 -1.5611 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2287 0.5487 -0.7626 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6850 1.4808 0.1875 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5838 -0.6476 -0.1184 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0803 -1.8668 -0.9178 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1564 -0.8001 1.2624 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5653 -0.8181 1.1389 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1067 -0.6729 -0.1939 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5844 -1.8448 0.5979 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8728 -1.8897 0.3901 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4214 -2.9879 0.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5234 0.5891 -1.7255 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6725 -0.6101 -2.8529 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1586 -1.0549 -2.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9027 -2.3113 -0.9962 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -1.5541 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3722 -0.0911 2.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7097 0.3828 0.8344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9693 1.9960 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8375 2.3739 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 2.5462 0.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0179 2.1211 -1.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7918 0.2442 -1.5722 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6426 1.5410 1.7288 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1128 1.6144 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3138 0.0402 2.2429 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6916 2.2976 0.2124 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4843 2.4456 -1.0756 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6029 2.1561 -2.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7196 0.6266 -2.3504 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0636 0.3174 -1.4215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7158 2.3941 -0.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3829 -2.0630 -1.7778 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -2.7450 -0.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0941 -1.6562 -1.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8732 -1.7100 1.7817 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9376 0.0655 1.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8686 -0.5332 0.2613 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8415 -0.9080 -1.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -1.8373 1.6522 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 -2.7641 0.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 16 17 1 6 16 18 1 0 18 19 1 0 16 14 1 0 14 15 1 0 14 13 1 0 13 12 1 0 12 10 1 0 10 11 1 1 10 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 2 3 4 22 1 1 22 23 2 0 22 21 1 0 21 20 1 0 20 16 1 0 20 10 1 0 4 9 1 0 2 6 1 0 17 45 1 0 17 46 1 0 17 47 1 0 18 48 1 0 18 49 1 0 19 50 1 0 14 43 1 6 15 44 1 0 13 41 1 0 13 42 1 0 12 39 1 0 12 40 1 0 11 36 1 0 11 37 1 0 11 38 1 0 9 35 1 6 8 33 1 0 8 34 1 0 7 31 1 0 7 32 1 0 6 30 1 1 5 28 1 0 5 29 1 0 3 26 1 0 3 27 1 0 1 24 1 0 1 25 1 0 21 52 1 0 21 53 1 0 20 51 1 6 M END