RDKit 3D 49 53 0 0 0 0 0 0 0 0999 V2000 -8.5496 -0.8201 1.2716 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6523 -1.8005 0.7883 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4959 -1.1520 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6589 0.1923 0.6637 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9161 0.3999 1.1806 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6782 1.2522 0.3737 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1765 1.2327 -1.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8252 0.8389 -1.0283 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1224 0.5729 -2.1962 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7588 0.2625 -2.1224 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0993 0.2448 -0.8799 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8093 0.5185 0.2949 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 0.8241 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2555 1.2004 1.5235 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3471 -0.0819 -0.7622 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7885 -0.5928 0.2624 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1504 0.2587 -1.8294 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5752 -0.0157 -1.8461 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3715 0.8913 -0.8918 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1528 0.1480 0.1553 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4817 0.1255 0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6061 0.7090 -0.3256 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8361 0.4720 0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0467 -0.3552 1.3452 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 -0.9339 2.0325 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6751 -0.7071 1.5452 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5764 -1.1363 2.0298 N 0 0 0 0 0 4 0 0 0 0 0 0 3.4450 -0.6687 1.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2239 1.1489 -0.6013 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.5521 -0.9857 1.6461 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8311 -2.8662 0.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5727 -1.5384 0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2607 1.3918 1.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1981 2.2044 0.5277 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7587 0.6748 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6229 0.6057 -3.1603 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2347 0.0184 -3.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3193 0.4975 1.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 0.8156 -2.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7167 -1.0779 -1.6174 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9097 0.1472 -2.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 1.6069 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0555 1.4998 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4568 1.3278 -1.2047 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0761 -0.4968 1.6719 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2317 -1.5421 2.9096 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5203 -1.7224 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9516 -1.5557 0.8107 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7912 -0.0695 1.8497 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 1 0 4 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 13 14 1 0 11 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 23 29 1 0 5 1 2 0 14 6 1 0 13 8 1 0 28 20 1 0 26 21 1 0 1 30 1 0 2 31 1 0 3 32 1 0 5 33 1 0 6 34 1 6 7 35 1 0 9 36 1 0 10 37 1 0 12 38 1 0 17 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 22 44 1 0 24 45 1 0 25 46 1 0 27 47 1 0 28 48 1 0 28 49 1 0 M CHG 1 27 1 M END