BJSI16 -OEChem-04022107032D 51 54 0 0 0 0 0 0 0999 V2000 2.9380 -3.8442 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -4.8442 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 3.1217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -0.5655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 -0.5655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 1.5036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -0.8442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5212 3.9307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 0.6946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.3991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 0.6946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 -0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4791 -0.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7579 1.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -1.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3511 2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7524 1.3991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9334 3.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9389 3.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3402 2.2081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -2.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -2.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -3.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -3.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -3.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5158 3.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1145 4.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 2.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4197 2.8632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0305 1.1273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7587 0.8031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9585 3.4980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2304 3.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 2.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5693 1.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7345 2.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0046 0.8327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6868 3.7926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9568 2.1433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2671 -2.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -2.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -3.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4510 3.2096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1324 3.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5806 4.4428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6809 5.0964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8623 5.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5481 4.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 28 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 15 2 0 0 0 0 5 16 2 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 7 18 1 0 0 0 0 8 21 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 12 2 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 24 2 0 0 0 0 18 25 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 23 2 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 26 1 0 0 0 0 24 43 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 M END $$$$