RDKit 3D 55 58 0 0 0 0 0 0 0 0999 V2000 -3.6897 4.1146 2.8224 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3666 2.7434 2.2489 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0265 2.8190 0.7615 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 1.5076 0.2541 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4529 1.0878 0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5637 1.7683 0.8494 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2036 -0.2081 -0.3108 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1697 -1.1943 -0.8086 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5253 -2.2463 -1.4446 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -2.0744 -1.4389 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1011 -0.6169 -0.5811 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2611 0.0615 -0.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5665 -0.1992 -0.6564 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9223 -1.1211 -1.3954 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5303 0.9143 -0.1971 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4748 1.4300 -1.3293 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5538 2.1430 -0.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9085 0.8765 0.2958 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5357 0.5759 0.9447 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3415 -0.7152 1.7224 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3882 -1.3575 2.0066 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1437 -0.9216 2.0835 O 0 0 0 0 0 1 0 0 0 0 0 0 6.1694 -0.0457 -0.8714 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3345 0.3076 -1.8571 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1356 -3.4463 -2.1054 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0059 -4.2605 -1.1474 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3569 -3.6195 -0.8393 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -2.3473 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6721 -1.1386 -0.7078 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 4.0356 3.9009 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5926 4.5319 2.3558 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 4.8161 2.6591 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5386 2.2931 2.8156 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2254 2.0703 2.3949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 3.1864 0.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2028 3.5120 0.5514 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1333 0.8175 0.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9319 1.7827 0.1291 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9985 2.0459 -2.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 2.9513 0.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3890 2.5296 -1.1033 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7486 0.9947 0.9794 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3938 1.3432 1.7237 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8254 -0.9049 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1795 -0.2180 -2.7866 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7192 -3.1246 -2.9773 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3491 -4.1098 -2.4908 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4684 -4.4652 -0.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2037 -5.2324 -1.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8949 -3.4195 -1.7728 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9599 -4.3531 -0.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -2.5449 0.9494 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3211 -2.0801 0.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0064 -0.2587 -0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0906 -1.0361 -1.7202 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 18 23 1 0 23 24 2 0 9 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 11 7 2 0 29 8 1 0 19 15 1 0 24 16 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 3 35 1 0 3 36 1 0 12 37 1 0 15 38 1 1 16 39 1 6 17 40 1 0 17 41 1 0 18 42 1 1 19 43 1 1 23 44 1 0 24 45 1 0 25 46 1 0 25 47 1 0 26 48 1 0 26 49 1 0 27 50 1 0 27 51 1 0 28 52 1 0 28 53 1 0 29 54 1 0 29 55 1 0 M CHG 1 22 -1 M END