B2K3WA -OEChem-04042106203D 42 45 0 1 0 0 0 0 0999 V2000 3.8203 2.8822 -0.1024 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.5666 -2.3075 0.2006 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -0.6130 2.1393 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 -2.3745 -1.3182 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9944 2.4508 -0.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7013 -1.4338 0.7631 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2235 -3.6589 0.2012 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6238 0.5870 0.0629 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8365 -0.9098 0.1847 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0887 -0.0623 -0.8021 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0206 -1.2235 -1.7389 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2908 -0.9597 -0.9781 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2186 -0.0973 0.4300 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0567 0.8264 0.1974 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9944 0.4147 1.6464 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7329 -2.4190 -0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7683 0.2934 0.2357 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2416 2.1866 -0.0504 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3352 1.1205 0.0261 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1381 3.0137 -0.2598 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1502 2.4807 -0.2215 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8404 1.2567 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0553 0.4030 -0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3118 0.9615 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4149 0.1186 -0.1449 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9327 -1.6982 0.2538 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2302 -1.2381 0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1532 0.8694 -1.3393 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0323 -1.0119 -2.8019 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1357 -0.5632 -1.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5636 -1.6307 -0.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3317 0.7403 2.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7243 1.1979 1.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5632 -0.7553 0.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7828 -3.8662 1.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2707 -4.4066 -0.4823 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2668 4.0758 -0.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9518 3.1850 -0.3931 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6776 -0.4131 0.2448 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4588 2.0194 -0.4117 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4118 0.5313 -0.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 -2.7461 0.4453 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 27 1 0 0 0 0 3 15 1 0 0 0 0 4 11 1 0 0 0 0 4 16 1 0 0 0 0 5 22 2 0 0 0 0 6 13 1 0 0 0 0 6 16 2 0 0 0 0 7 16 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 19 1 0 0 0 0 8 22 1 0 0 0 0 8 39 1 0 0 0 0 9 23 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 27 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 M END $$$$