RDKit 3D 42 46 0 0 0 0 0 0 0 0999 V2000 5.3342 0.3916 0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9669 0.7174 1.0381 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1153 -0.5087 0.8656 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6731 -0.1582 0.5092 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6361 -1.4317 1.3193 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3984 -0.8664 1.3561 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9103 -0.1564 -0.2120 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9815 1.3435 -0.1099 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1505 1.6784 -0.9873 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0745 0.6046 -0.7535 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7384 0.6857 0.5269 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2459 -0.7558 0.6756 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9575 -1.5106 0.3242 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2844 -0.5870 -0.6435 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4593 2.1630 -0.5953 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7669 0.9902 -1.8336 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6257 -0.3175 -0.9740 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1000 -0.3324 -1.3748 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6849 -1.1167 -0.3161 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -0.9345 -0.1875 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6937 1.1462 -0.2407 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1114 0.3252 1.2931 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0327 0.9500 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5746 1.5649 0.4412 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1684 -1.1945 1.7363 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4451 0.8478 0.8761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1868 -0.4265 -0.9954 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2366 1.6953 0.9201 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 2.6722 -0.8169 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8093 1.5986 -2.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0259 0.8257 1.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5426 1.4166 0.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -0.9718 1.6842 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0002 -0.9359 -0.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3421 -1.6719 1.2346 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2721 -2.4669 -0.1019 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2381 -1.1267 -1.6276 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2054 -1.3017 -1.2838 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2029 -0.8031 -2.3765 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4613 0.7037 -1.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6331 -1.0270 -1.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4876 -1.7184 0.5013 H 0 0 0 0 0 0 0 0 0 0 0 0 12 13 1 0 13 14 1 0 14 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 1 1 0 1 2 1 0 2 3 1 0 17 16 1 0 16 15 1 0 15 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 10 14 1 0 8 7 1 0 3 4 1 0 3 19 1 0 12 33 1 0 12 34 1 0 13 35 1 0 13 36 1 0 14 37 1 6 7 27 1 6 4 26 1 6 17 38 1 1 18 39 1 0 18 40 1 0 20 41 1 0 20 42 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 1 8 28 1 1 9 29 1 0 9 30 1 0 11 31 1 0 11 32 1 0 M END