RDKit 3D 45 47 0 0 0 0 0 0 0 0999 V2000 -3.2151 2.6684 -1.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2087 1.5002 -0.3142 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4417 1.0167 0.3461 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0523 0.9079 -0.0735 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9646 -0.2411 0.8247 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3297 -1.3898 0.1208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9812 -2.1629 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2906 -1.8821 -1.1576 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3435 -3.2384 -1.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0458 -3.5354 -1.1151 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6015 -2.7572 -0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -1.6907 0.4534 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6802 -0.9176 1.4015 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0899 -0.7982 1.3351 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4840 0.5670 0.8533 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8777 1.1038 -0.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2085 2.3584 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1607 3.1352 -0.1098 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5038 4.4030 -0.5744 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7726 2.6036 1.0112 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 1.3436 1.4771 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7293 -1.7772 0.4195 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0107 -3.0569 0.2097 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0667 2.4857 -1.9536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2872 2.6501 -1.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3817 3.6205 -0.7348 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2639 1.7598 0.2269 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 0.8698 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8107 0.0852 -0.0872 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 1.2516 -0.5344 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4047 -0.0183 1.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -0.6001 1.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7896 -2.4352 -1.8409 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8923 -3.8173 -2.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -4.3719 -1.5791 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4787 -0.9303 2.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1217 0.4788 -0.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7182 2.7694 -1.6223 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2622 4.4750 -1.2571 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5298 3.2103 1.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9196 0.9251 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8734 -1.3042 -0.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7439 -2.0152 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5216 -3.6332 -0.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9536 -3.6161 1.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 22 1 0 22 23 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 12 6 1 0 21 15 1 0 23 11 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 3 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 8 33 1 0 9 34 1 0 10 35 1 0 14 36 1 1 22 42 1 0 22 43 1 0 23 44 1 0 23 45 1 0 16 37 1 0 17 38 1 0 19 39 1 0 20 40 1 0 21 41 1 0 M END