BS1A2Q -OEChem-04012113383D 43 45 0 0 0 0 0 0 0999 V2000 -0.4630 -1.0017 -1.4393 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6692 0.0078 0.8319 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9309 -2.8589 1.1562 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -1.5139 -0.5059 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0516 -2.6488 0.4854 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1636 1.3823 -0.8925 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4793 1.4188 1.4178 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1611 -1.5916 -1.1805 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -0.4801 -0.4639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7431 -1.8315 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7629 0.8242 -0.9502 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5838 -0.7450 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3152 -2.6530 0.2861 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6028 -1.8149 -0.3682 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4077 1.8637 -0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2287 0.2944 1.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1405 1.5988 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3377 -1.4639 -0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9988 -2.0386 0.2447 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1069 2.1707 -1.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4438 2.2062 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2055 2.6179 -0.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2808 1.0548 0.4041 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9317 2.5634 -2.6079 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5223 2.6389 2.1504 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7357 -2.5204 -1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1695 -1.4020 -2.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1971 1.0456 -1.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6595 -1.7564 1.0837 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9352 -3.2865 0.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3391 2.8793 -0.6584 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7989 0.0883 2.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1433 -0.8460 -1.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6424 2.4081 1.3992 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1157 -2.2121 0.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 -1.2190 -1.2328 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3646 3.2498 -0.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9826 3.6518 -2.7127 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7158 2.1263 -3.2349 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9652 2.2123 -2.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4936 2.2813 1.9537 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8404 2.2358 3.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 3.7307 2.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 18 1 0 0 0 0 2 23 1 0 0 0 0 3 19 2 0 0 0 0 4 14 1 0 0 0 0 4 19 1 0 0 0 0 4 33 1 0 0 0 0 5 13 1 0 0 0 0 5 14 2 0 0 0 0 6 20 2 0 0 0 0 6 23 1 0 0 0 0 7 21 1 0 0 0 0 7 23 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 13 2 0 0 0 0 11 15 1 0 0 0 0 11 28 1 0 0 0 0 12 16 2 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 15 17 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 20 22 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$