LDW0Z3 -OEChem-05032300332D 41 43 0 1 0 0 0 0 0999 V2000 9.4279 0.1164 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4965 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.7157 2.6041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5057 -0.7699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7941 -2.6041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 0.7092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5393 -0.5131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8256 2.1483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4243 1.8984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8812 -0.8742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6064 0.0006 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6064 -1.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2785 0.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9841 1.1609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9721 1.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4267 0.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8825 -0.8239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3371 -1.7643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3358 -1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3673 0.5727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6047 -1.6277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2264 -1.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1018 -0.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0192 0.2486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3499 0.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2900 -1.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9593 -1.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2178 -0.3536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6674 -1.3684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3046 -2.4338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9550 -1.8458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3670 -1.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 17 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 7 1 0 0 0 0 4 38 1 0 0 0 0 5 24 2 0 0 0 0 11 6 1 1 0 0 0 6 19 2 0 0 0 0 7 19 1 0 0 0 0 7 32 1 0 0 0 0 8 20 2 0 0 0 0 9 21 2 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 2 0 0 0 0 15 29 1 0 0 0 0 16 18 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$