BBT8U5 -OEChem-04012113472D 43 46 0 0 0 0 0 0 0999 V2000 10.6895 -3.3769 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0864 -3.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6613 3.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7953 1.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 0.5669 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -1.5480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 -0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 -0.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -1.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 -0.5573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 -0.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 -0.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 1.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -1.7567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 -2.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -1.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -2.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6613 2.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -2.8353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6907 -1.1397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0232 -2.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6697 -0.9356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3359 -1.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8742 0.5453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1122 0.7832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1824 -2.0785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 -2.3339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6029 -0.8470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4339 -0.0668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1379 1.4592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7394 2.1495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -2.3441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 0.8032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -2.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -0.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8504 -3.4242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2776 -0.6774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1244 3.3769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8635 -0.3467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9429 -1.5547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 17 2 0 0 0 0 3 21 1 0 0 0 0 3 41 1 0 0 0 0 4 21 2 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 16 2 0 0 0 0 14 21 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 18 1 0 0 0 0 15 35 1 0 0 0 0 16 19 1 0 0 0 0 16 36 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 22 24 1 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$