BEXC97 -OEChem-04022115383D 61 67 0 1 0 0 0 0 0999 V2000 -2.7778 -3.7344 0.1145 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.3079 4.0376 -0.1241 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0805 0.4529 0.7129 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1615 -1.8902 -1.8178 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1172 -0.5638 0.1335 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0425 1.6721 -1.8765 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1193 1.3137 3.2902 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7379 -2.5591 0.0285 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0148 2.0518 -0.1107 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6075 -0.3542 0.0779 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6265 -1.3155 0.0391 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4598 1.4614 -0.0459 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2306 -0.2729 0.0248 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0526 -0.8003 0.0287 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5910 -0.6453 -1.4097 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6704 0.4439 -1.5122 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3962 0.6268 -0.1772 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5749 -0.6952 0.0188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3967 0.9745 0.9458 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8178 -1.4125 0.0378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2335 -2.6450 0.0783 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6588 0.7018 -0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1987 -2.7448 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9786 1.2653 -0.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0872 -0.8427 0.0184 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1708 0.5478 -0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 0.5686 2.3414 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5233 2.6621 -0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0529 -3.7835 0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0895 2.7343 -0.0862 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7557 -4.0458 0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4399 -1.3821 0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5781 0.9206 -0.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4531 -5.0429 0.1522 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9294 -5.1741 0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 3.8871 -0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5879 3.9625 -0.1232 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3452 -0.6276 -0.5773 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5466 5.1062 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1583 5.1412 -0.1596 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6201 -1.4638 0.6684 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7684 -0.4291 -2.1021 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 0.2036 -2.3121 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0998 1.4685 -0.2371 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2841 2.0521 0.9744 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9174 0.8024 2.4869 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6888 -0.4948 2.5352 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3902 1.2650 -0.3473 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4336 -1.7978 -2.7468 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8316 -4.1881 0.1233 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6265 1.5443 -2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0612 -5.9447 0.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3772 -6.1640 0.1852 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3172 3.8999 -0.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 -1.5146 -0.2329 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -0.7335 -1.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9672 0.2482 -0.3676 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4302 1.0457 4.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1094 6.0355 -0.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3418 6.1068 -0.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8268 -0.3957 -0.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 37 1 0 0 0 0 3 14 1 0 0 0 0 3 19 1 0 0 0 0 4 15 1 0 0 0 0 4 49 1 0 0 0 0 5 17 1 0 0 0 0 5 38 1 0 0 0 0 6 16 1 0 0 0 0 6 51 1 0 0 0 0 7 27 1 0 0 0 0 7 58 1 0 0 0 0 8 32 2 0 0 0 0 9 33 2 0 0 0 0 10 13 1 0 0 0 0 10 61 1 0 0 0 0 11 14 1 0 0 0 0 11 18 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 30 1 0 0 0 0 12 48 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 19 1 0 0 0 0 17 44 1 0 0 0 0 18 20 1 0 0 0 0 18 22 2 0 0 0 0 19 27 1 0 0 0 0 19 45 1 0 0 0 0 20 23 1 0 0 0 0 20 25 2 0 0 0 0 21 23 2 0 0 0 0 21 29 1 0 0 0 0 22 24 1 0 0 0 0 23 31 1 0 0 0 0 24 26 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 32 1 0 0 0 0 26 33 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 36 1 0 0 0 0 29 34 2 0 0 0 0 30 37 1 0 0 0 0 31 35 2 0 0 0 0 31 50 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 35 53 1 0 0 0 0 36 39 2 0 0 0 0 36 54 1 0 0 0 0 37 40 2 0 0 0 0 38 55 1 0 0 0 0 38 56 1 0 0 0 0 38 57 1 0 0 0 0 39 40 1 0 0 0 0 39 59 1 0 0 0 0 40 60 1 0 0 0 0 M END $$$$