BAU02I -OEChem-04012114363D 54 57 0 0 0 0 0 0 0999 V2000 -3.7654 1.6407 3.3744 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.1212 -3.7884 1.1680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9736 1.6157 1.8688 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6167 -2.0514 -1.8576 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8057 0.3762 -0.8579 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6674 -0.9121 -1.8968 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0557 -1.5561 -1.6559 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7394 -1.4455 -2.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5665 -2.8490 -3.1682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2754 -3.0063 -0.7051 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7868 -0.3349 -2.1427 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2317 -0.7574 -0.3981 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1762 -0.3648 0.2929 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5185 1.7645 -0.8757 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5771 -1.4020 0.7843 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0491 0.6208 -0.4266 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8763 0.1054 1.5868 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1531 2.4455 0.3024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8893 -1.5802 0.2022 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6184 2.5337 -2.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7421 -0.6590 1.9533 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 1.3637 0.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2534 -0.6291 2.7251 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8768 3.8242 0.2807 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5605 0.7239 1.9323 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2663 -2.3038 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3478 3.9047 -2.0707 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9453 -1.8293 2.5996 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9735 4.5500 -0.9019 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9737 -0.2253 -2.6945 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7003 -0.3950 -0.9355 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7184 -2.4313 -1.6588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3155 -0.9545 -2.5369 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0148 -2.2165 -1.4189 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8096 -1.9136 -3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6654 -2.1490 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6341 -3.4154 -3.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4036 -3.5546 -3.1679 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4168 -3.6240 -0.9829 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -2.4281 0.1942 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1269 -3.6748 -0.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7817 -0.7228 -2.3923 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5161 0.2830 -3.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7358 -2.4759 0.8156 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7863 1.1341 -1.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1943 -1.9817 -0.7608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9682 2.1241 -2.9976 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0151 -1.1706 2.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0692 2.4406 0.7108 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0112 -0.2725 3.7243 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5832 4.3484 1.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4447 4.4666 -2.9952 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2263 -2.3787 3.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7631 5.6151 -0.9077 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 12 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 11 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 2 0 0 0 0 13 19 1 0 0 0 0 14 18 1 0 0 0 0 14 20 2 0 0 0 0 15 21 1 0 0 0 0 15 44 1 0 0 0 0 16 22 2 0 0 0 0 16 45 1 0 0 0 0 17 23 1 0 0 0 0 18 24 2 0 0 0 0 19 26 2 0 0 0 0 19 46 1 0 0 0 0 20 27 1 0 0 0 0 20 47 1 0 0 0 0 21 25 2 0 0 0 0 21 48 1 0 0 0 0 22 25 1 0 0 0 0 22 49 1 0 0 0 0 23 28 2 0 0 0 0 23 50 1 0 0 0 0 24 29 1 0 0 0 0 24 51 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M CHG 1 4 1 M END $$$$