BL86HF -OEChem-04012115173D 34 36 0 0 0 0 0 0 0999 V2000 -2.1331 -1.8396 2.0454 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.2542 1.2134 0.4683 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8345 -1.6657 -0.9856 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6882 -0.6493 -0.8608 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0987 0.7429 -0.1504 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6463 0.7489 -0.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0342 2.9287 0.3834 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7681 3.5315 0.8602 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3318 -1.8319 -1.3887 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3296 0.4964 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 -0.4526 -0.6415 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3266 1.3467 -0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4394 -2.9717 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7189 2.6048 0.3988 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3741 -0.8681 -0.5113 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 1.9943 -0.0722 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9055 -0.9538 0.7757 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0426 -0.1387 -1.4947 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2038 -2.5823 0.8228 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1053 -0.3103 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2425 0.5045 -1.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7739 0.4188 0.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8259 -2.2670 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7718 -2.1557 -2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3299 -1.5465 -1.7428 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4479 -3.3188 -0.0641 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9316 -3.8250 -0.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9479 2.2873 -0.0702 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6474 -0.0573 -2.5046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2141 3.2923 0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 4.4393 1.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5229 -0.3747 2.0817 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7525 1.0693 -1.9676 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3774 -1.9855 2.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 22 1 0 0 0 0 3 11 1 0 0 0 0 3 15 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 11 2 0 0 0 0 5 12 1 0 0 0 0 6 10 2 0 0 0 0 6 16 1 0 0 0 0 7 14 1 0 0 0 0 7 16 2 0 0 0 0 8 14 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 13 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 12 14 2 0 0 0 0 13 19 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 28 1 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 18 29 1 0 0 0 0 19 23 3 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 23 34 1 0 0 0 0 M END $$$$