RDKit 3D 70 74 0 0 0 0 0 0 0 0999 V2000 0.4598 0.5727 -2.7043 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5719 0.5966 -1.1757 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9976 0.3814 -0.7339 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3389 -0.3394 0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0321 -0.3610 0.5923 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1831 0.5450 -0.8506 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0664 0.9418 -1.4123 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4313 1.0396 -1.3825 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 -0.1524 -1.9572 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9988 0.3444 -3.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8735 -1.4674 -1.8698 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7845 -0.0671 -0.7612 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8219 -0.9871 0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8574 -0.9234 1.2261 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8551 0.0424 1.0907 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8283 0.9461 0.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7926 0.8902 -0.9095 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1294 0.1180 2.2442 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3967 -1.0489 1.2997 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0784 -0.5810 1.0758 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3752 -0.4493 -0.4656 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8756 -0.1817 -0.7825 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8665 -0.8160 0.2331 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2253 -2.0370 0.8951 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0082 -1.6443 1.7319 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3048 -1.1373 -0.2643 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4552 -2.3397 -1.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9204 0.1046 -0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5592 0.4594 -2.0339 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8197 0.8385 -0.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4362 0.4784 1.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5754 1.4744 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0884 2.6975 0.5072 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3674 2.0824 -0.6839 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1037 -0.6901 -2.0902 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 0.7720 1.8041 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2111 1.2206 -3.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 -0.4400 -3.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 0.9431 -3.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2863 1.6051 -0.8486 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2525 1.7204 -2.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0513 -1.7470 0.3976 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 -1.6307 2.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6143 1.6890 -0.0823 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7779 1.5906 -1.7415 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6871 -0.9096 2.3474 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -2.1216 1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1255 -1.4283 -0.9093 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0518 0.9006 -0.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9978 -0.0690 1.0285 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9452 -2.5456 1.5478 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9215 -2.7656 0.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4581 -2.5663 1.9584 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3629 -1.2795 2.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8797 -1.4046 0.6271 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1062 -3.2619 -0.7243 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9289 -2.2228 -2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5141 -2.4842 -1.4474 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6811 0.5854 1.8836 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8031 -0.5519 1.0761 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4889 1.0841 0.8032 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7938 1.6810 2.3257 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3809 3.2684 1.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9013 3.3669 0.2093 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 2.7262 -1.0777 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0637 1.8357 -1.4929 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9167 -0.2634 -2.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1293 0.6593 2.8837 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2851 1.1777 1.6582 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4265 1.5354 1.4689 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 2 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 2 0 9 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 15 18 1 0 4 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 23 26 1 0 26 27 1 0 26 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 22 35 1 0 20 36 1 1 21 2 1 0 7 3 1 0 17 12 1 0 25 20 1 0 34 30 1 0 1 37 1 0 1 38 1 0 1 39 1 0 2 40 1 1 8 41 1 0 13 42 1 0 14 43 1 0 16 44 1 0 17 45 1 0 19 46 1 0 19 47 1 0 21 48 1 6 22 49 1 6 23 50 1 1 24 51 1 0 24 52 1 0 25 53 1 0 25 54 1 0 26 55 1 1 27 56 1 0 27 57 1 0 27 58 1 0 31 59 1 0 31 60 1 0 32 61 1 0 32 62 1 0 33 63 1 0 33 64 1 0 34 65 1 0 34 66 1 0 35 67 1 0 36 68 1 0 36 69 1 0 36 70 1 0 M END