RDKit 3D 48 50 0 0 0 0 0 0 0 0999 V2000 4.6964 1.6720 2.1135 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 0.9427 1.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5036 0.2140 0.2818 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4864 1.0325 1.0621 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7851 0.3243 0.1016 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9897 1.1745 -0.8412 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1185 0.3596 -1.4137 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3115 0.8928 -2.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0907 -0.9723 -1.5328 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5218 -1.6508 -0.4364 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3728 -2.7933 -0.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8562 -2.3166 -0.8192 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8327 -0.7043 0.6683 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3022 -0.1651 1.4299 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3172 0.6467 0.7847 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7275 0.2038 1.1816 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3684 1.0977 2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5444 0.1020 -0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5502 -0.1006 -1.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3823 0.7321 -0.6806 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0587 1.9508 2.9731 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2047 2.5460 1.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5085 0.9842 2.4484 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5003 -0.2483 -0.5256 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 2.0483 -0.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6639 1.6184 -1.6264 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2644 0.5334 -3.2776 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5748 0.5454 -3.4203 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2616 2.0043 -2.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -3.2940 -0.9664 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1813 -3.5761 0.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2426 -2.4994 0.5589 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5897 -2.2303 0.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2697 -1.8621 -1.7499 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7364 -3.3886 -1.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4628 -1.2937 1.4058 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 0.3790 2.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8036 -1.0520 1.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2606 1.7066 1.1835 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6171 -0.8340 1.6031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9028 1.9066 1.6207 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1175 0.5056 2.7583 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6557 1.5491 2.9141 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2642 -0.7251 0.0384 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0847 1.0492 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -1.1317 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0048 0.3353 -2.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6276 1.7814 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 17 16 1 0 16 18 1 0 18 19 1 0 19 20 1 0 20 15 1 0 15 14 1 0 14 13 1 0 13 5 1 0 5 6 1 0 6 7 1 0 7 8 1 6 7 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 15 16 1 0 10 13 1 0 7 20 1 0 17 41 1 0 17 42 1 0 17 43 1 0 16 40 1 1 18 44 1 0 18 45 1 0 19 46 1 0 19 47 1 0 20 48 1 1 15 39 1 1 14 37 1 0 14 38 1 0 13 36 1 1 5 24 1 6 6 25 1 0 6 26 1 0 8 27 1 0 8 28 1 0 8 29 1 0 11 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 12 34 1 0 12 35 1 0 1 21 1 0 1 22 1 0 1 23 1 0 M END