RDKit 3D 59 62 0 0 0 0 0 0 0 0999 V2000 -4.4871 2.1057 3.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1879 1.6369 2.5805 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2315 0.7088 1.1855 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8767 0.1962 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3471 -0.2037 1.2797 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5092 1.9206 -0.1157 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6475 1.1995 -1.4504 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9608 0.9229 -1.8866 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2052 0.2838 -3.1014 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -0.0959 -3.9102 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8364 0.1518 -3.4983 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5633 0.7986 -2.2729 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1058 0.9468 -1.8932 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6303 -0.2700 -1.1780 N 0 0 0 0 0 4 0 0 0 0 0 0 0.8424 -0.5867 -1.1817 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0479 -1.9629 -0.5808 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8217 -2.1975 0.7885 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9782 -3.4786 1.3179 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3612 -4.5344 0.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5789 -4.3173 -0.8626 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4137 -3.0417 -1.4036 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7079 0.5112 -0.5138 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2727 1.6529 -0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0971 0.2326 -0.0442 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6613 0.8613 1.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2356 1.8328 1.9647 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1182 2.2434 2.8995 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 1.7297 2.9621 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9682 0.8342 2.0853 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 0.3592 1.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3014 -0.4655 0.0851 N 0 0 0 0 0 4 0 0 0 0 0 0 4.0868 -0.6701 -0.7304 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0961 1.2537 3.4321 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0259 2.7064 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2866 2.7327 4.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6157 1.1913 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4233 2.4777 0.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6669 2.6196 -0.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8236 1.2003 -1.2771 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2302 0.0798 -3.4151 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3408 -0.5869 -4.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0312 -0.1643 -4.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4898 1.0653 -2.7925 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9492 1.8182 -1.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1634 -1.0850 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -0.1630 -0.1901 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1319 -0.6003 -2.2411 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -1.4052 1.4615 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -3.6680 2.3726 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4657 -5.5363 0.9087 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8502 -5.1561 -1.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5599 -2.9181 -2.4754 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2305 2.2447 1.9294 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8357 2.9949 3.6372 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1055 2.1144 3.7649 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9884 0.4774 2.1571 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 -0.9080 -0.0228 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2986 -0.3607 -1.7582 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8408 -1.7293 -0.6734 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 3 5 2 0 3 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 15 22 1 0 22 23 2 0 22 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 12 7 1 0 21 16 1 0 32 24 1 0 30 25 1 0 1 33 1 0 1 34 1 0 1 35 1 0 2 36 1 0 6 37 1 0 6 38 1 0 8 39 1 0 9 40 1 0 10 41 1 0 11 42 1 0 13 43 1 0 13 44 1 0 14 45 1 0 14 46 1 0 15 47 1 6 17 48 1 0 18 49 1 0 19 50 1 0 20 51 1 0 21 52 1 0 26 53 1 0 27 54 1 0 28 55 1 0 29 56 1 0 31 57 1 0 32 58 1 0 32 59 1 0 M CHG 2 14 1 31 1 M END