RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 -4.0541 -1.0765 2.1977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6344 -0.1281 1.2139 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6725 0.6562 1.4309 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 1.3603 0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9334 1.0004 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1471 0.0587 -0.0611 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -0.6475 -0.6921 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7588 0.1478 -0.7764 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4317 1.1855 0.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2232 1.8817 -0.0319 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7223 1.5554 -1.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3846 0.5083 -1.8876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8246 -0.1885 -1.7646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8617 2.2888 -1.0761 N 0 0 0 0 0 2 0 0 0 0 0 0 3.2643 1.7697 -1.6075 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 2.5489 -1.2317 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3369 0.9823 -2.8296 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6698 0.3899 -0.5164 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 -0.3546 -0.5102 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6733 -1.3117 0.5068 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4729 -1.1572 1.0814 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8651 -0.1452 0.4854 N 0 0 0 0 0 4 0 0 0 0 0 0 5.6608 -2.3103 0.8665 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2278 -0.2124 -1.5341 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.9848 -0.8892 2.3386 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5442 -0.9668 3.1706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1921 -2.1098 1.8646 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6591 2.0879 0.1779 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7624 1.3319 -1.6883 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8594 -1.5776 -0.1431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3875 -0.9162 -1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1175 1.5006 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0304 2.7134 0.6483 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0409 0.2314 -2.7126 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -0.9823 -2.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0676 -1.7550 1.8879 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9286 0.2202 0.6538 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2938 -2.9092 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8414 -2.9669 0.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5889 -1.8143 1.1632 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 11 14 1 0 14 15 1 0 15 16 2 0 15 17 2 0 15 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 2 0 20 23 1 0 19 24 1 0 6 2 1 0 13 8 1 0 22 18 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 5 29 1 0 7 30 1 0 7 31 1 0 9 32 1 0 10 33 1 0 12 34 1 0 13 35 1 0 21 36 1 0 22 37 1 0 23 38 1 0 23 39 1 0 23 40 1 0 M CHG 2 14 -1 22 1 M END