RDKit 3D 44 47 0 0 0 0 0 0 0 0999 V2000 4.2244 -0.0659 2.8094 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3811 -1.4005 2.4515 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3341 -2.0961 1.8369 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1235 -1.4090 1.5959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9424 -0.0535 1.9323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 0.5960 2.5504 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7132 0.6259 1.6487 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3993 -0.0024 0.9693 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4550 1.0438 1.0717 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 2.1966 1.6438 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3858 1.9466 2.0063 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1176 2.7843 2.5195 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6557 3.2822 1.9225 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.8114 0.6942 0.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2691 -0.3995 0.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4814 1.5556 -0.3998 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0398 2.6976 -1.0457 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9943 3.2247 -1.9638 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1384 2.4638 -2.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0585 1.1283 -0.9434 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1287 -0.3488 -0.5015 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7395 0.4204 -1.2983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9463 0.1125 -2.6473 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2654 -0.9514 -3.2407 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6182 -1.6979 -2.4613 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8121 -1.4220 -1.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4162 -2.7441 -3.0616 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.2684 -3.8964 -2.6354 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2198 -2.4092 -3.9456 O 0 0 0 0 0 1 0 0 0 0 0 0 0.5832 -1.2754 -4.9082 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5012 -3.5493 1.4365 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5212 -4.1082 0.8498 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6134 -4.1051 1.7107 O 0 0 0 0 0 1 0 0 0 0 0 0 5.0396 0.4662 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3199 -1.9141 2.6487 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3295 -1.9890 1.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9585 1.6369 2.8476 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6871 -0.8964 1.5372 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0746 3.1530 -0.8525 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8423 4.1202 -2.5516 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0216 2.6268 -2.6058 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2732 1.2661 -0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6437 0.7157 -3.2232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5046 -2.0232 -0.5109 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 10 13 1 0 9 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 8 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 2 0 27 29 1 0 24 30 1 0 3 31 1 0 31 32 2 0 31 33 1 0 6 1 1 0 11 7 1 0 20 16 1 0 26 21 1 0 1 34 1 0 2 35 1 0 4 36 1 0 6 37 1 0 8 38 1 1 17 39 1 0 18 40 1 0 19 41 1 0 22 42 1 0 23 43 1 0 26 44 1 0 M CHG 4 13 -1 27 1 29 -1 33 -1 M END