BSHE36 -OEChem-04022110473D 47 48 0 1 0 0 0 0 0999 V2000 4.9890 2.9621 1.8149 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1084 2.0421 0.6827 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 2.3858 -0.6284 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1021 -1.2140 1.9507 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2632 1.0806 -0.9255 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 0.5090 -0.0136 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8710 -0.7393 -0.6148 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6825 2.2946 -1.6556 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9907 -1.9611 -0.5238 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 1.2940 -2.0424 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1636 1.8092 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2483 1.6047 0.2572 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7249 1.0418 -0.9045 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0661 -2.7928 0.5936 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1017 -2.2590 -1.5563 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8161 1.6460 1.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4688 0.0176 0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8646 1.8335 -0.7622 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2523 -3.9228 0.6781 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2879 -3.3887 -1.4718 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3525 -0.2151 1.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3633 -4.2206 -0.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7482 1.6008 0.2916 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4922 0.5763 1.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9187 -1.9845 1.7456 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7122 0.2794 0.9299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8148 -0.9542 -0.0954 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1581 -0.5686 -1.6614 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4361 0.9913 -1.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1238 3.2558 -1.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0415 2.4954 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 0.3453 -2.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3229 1.6697 -2.9122 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7525 -2.5695 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0325 -1.6190 -2.4318 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3236 0.7037 1.8794 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0096 1.8198 2.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5728 -0.5726 -0.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0738 2.6358 -1.4648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3095 -4.5694 1.5488 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4057 -3.6197 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2716 -5.0992 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6353 2.2174 0.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1841 0.4000 2.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8727 -2.7276 2.5484 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0161 -1.3693 1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9641 -2.5363 0.8014 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 11 2 0 0 0 0 3 12 2 0 0 0 0 4 21 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 12 16 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 19 1 0 0 0 0 14 34 1 0 0 0 0 15 20 2 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 21 1 0 0 0 0 17 38 1 0 0 0 0 18 23 2 0 0 0 0 18 39 1 0 0 0 0 19 22 2 0 0 0 0 19 40 1 0 0 0 0 20 22 1 0 0 0 0 20 41 1 0 0 0 0 21 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$