BHVJ47 -OEChem-04022108403D 40 42 0 1 0 0 0 0 0999 V2000 -7.5710 0.3371 0.3229 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9747 2.2954 -1.6171 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6895 -0.7445 -0.1785 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9886 0.8524 0.2797 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4658 0.6047 0.5707 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2138 1.2695 0.9899 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1081 0.6592 1.4172 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1729 2.3241 -0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4866 1.8298 -0.5971 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1358 0.2480 0.3879 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 0.1677 0.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0931 0.4469 -0.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6071 -0.7854 1.1149 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3117 -0.2221 -1.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8258 -1.4542 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6139 -0.1042 0.1445 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -1.1725 -0.0677 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 0.4117 0.4169 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4564 -1.2991 -0.5381 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9812 -1.8873 -0.1902 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0011 -0.2873 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5871 -1.9980 -0.9602 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8595 -1.4921 -0.6938 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7071 1.7218 1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5341 1.2057 2.2668 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9985 -0.3977 1.6771 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3529 3.2920 0.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5608 2.4410 -0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6589 1.4767 1.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8743 1.1698 -1.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9862 -1.0323 1.9696 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9672 0.0041 -1.8574 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1012 -2.1920 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9764 1.3515 0.9536 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5079 -1.7546 -0.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3785 -2.1562 0.7944 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8544 -2.8012 -0.7789 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7333 -1.2573 -0.6775 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4784 -2.9363 -1.4965 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7317 -2.0476 -1.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 9 2 0 0 0 0 3 10 2 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 10 1 0 0 0 0 5 16 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 24 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 13 15 2 0 0 0 0 13 31 1 0 0 0 0 14 17 2 0 0 0 0 14 32 1 0 0 0 0 15 17 1 0 0 0 0 15 33 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 34 1 0 0 0 0 19 22 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$