RDKit 3D 40 42 0 0 0 0 0 0 0 0999 V2000 -3.6230 0.6043 -3.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2862 0.6296 -1.7139 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3864 1.2973 -1.4261 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6435 1.0490 -0.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6964 0.2080 0.4243 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8279 -0.0468 -0.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6769 -0.9357 -0.5296 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5587 -0.3945 0.3251 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0947 0.9189 0.1978 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0466 1.3866 0.9992 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6004 0.5595 1.9298 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1241 -0.7548 2.0484 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9283 -1.2285 1.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5961 1.0831 2.6870 N 0 0 0 0 0 2 0 0 0 0 0 0 2.9509 0.3152 2.9768 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9164 -1.0481 3.5024 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1397 1.1009 3.2734 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5393 -0.2044 1.3604 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7879 0.5489 0.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2286 -0.3417 -0.7432 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -1.5845 -0.2385 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 -1.5158 1.0164 N 0 0 0 0 0 4 0 0 0 0 0 0 4.6017 0.0269 -2.0939 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 2.2729 0.0389 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 1.2776 -3.7367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6497 -0.4032 -3.4674 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5812 0.9296 -2.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4969 1.4875 0.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5619 -0.2040 1.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3033 -1.1307 -1.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0553 -1.8851 -0.1309 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5578 1.6105 -0.5024 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2595 2.4282 0.8958 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5447 -1.4290 2.7943 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2626 -2.2535 1.3994 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -2.4832 -0.7646 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7308 -2.2420 1.7225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7474 0.4922 -2.5928 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8986 -0.8648 -2.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4434 0.7239 -2.0610 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