BAD2I6 -OEChem-04042106243D 43 46 0 1 0 0 0 0 0999 V2000 4.9640 0.8515 1.7228 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -0.1586 2.5769 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8281 -2.4187 -0.2033 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9194 -4.3252 -0.5907 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9856 2.5513 -1.4872 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4809 1.2688 0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5365 1.5708 0.6058 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7998 3.7198 0.0248 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5212 -1.0437 -0.0607 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1899 -0.8993 -0.1431 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8784 0.2142 -0.1258 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0652 0.3536 -0.9554 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8581 1.4899 -1.9026 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1548 1.3820 -1.1481 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2039 0.3002 0.2822 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1563 -0.7550 0.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0413 -0.1049 1.4983 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4496 2.5450 -0.2328 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8052 -0.4102 0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5325 -2.0777 -0.1669 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1697 -1.3879 -0.0961 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5576 -3.0555 -0.3654 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2066 -2.7105 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0841 0.2207 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5687 0.2747 0.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2310 1.4747 0.3122 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6203 1.4695 0.2531 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5406 -0.8653 -0.1932 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2952 0.2813 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7196 0.2444 -0.0711 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3056 -0.6089 -1.3907 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 1.2660 -2.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3527 2.1005 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0357 1.0827 -1.7038 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5724 -1.0547 1.4079 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 0.6126 0.2855 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7567 4.4605 -0.6666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3411 3.8835 0.9143 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -3.4829 -0.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1707 -1.8115 -0.2184 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7071 2.4029 0.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1634 2.3983 0.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0069 -1.8249 -0.3975 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 3 20 1 0 0 0 0 4 22 1 0 0 0 0 5 13 1 0 0 0 0 5 18 1 0 0 0 0 6 24 2 0 0 0 0 7 15 1 0 0 0 0 7 18 2 0 0 0 0 8 18 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 21 1 0 0 0 0 9 24 1 0 0 0 0 9 40 1 0 0 0 0 10 25 2 0 0 0 0 10 28 1 0 0 0 0 11 30 3 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 16 20 2 0 0 0 0 17 35 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 23 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 29 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 M END $$$$