BTWI25 -OEChem-04012116062D 42 45 0 0 0 0 0 0 0999 V2000 8.9211 3.7922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3125 -0.7524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5921 -1.7723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 1.2714 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7435 -3.2822 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9211 0.7922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7871 2.2922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4407 -0.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3241 -1.7523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5806 -0.7724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4639 -2.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1727 -0.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7319 -2.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1611 0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0551 1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -1.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0551 2.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1611 2.8269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 2.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9211 2.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8833 -3.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0116 -3.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7871 1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8338 0.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0367 0.2079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5428 -2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9334 -1.6376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3618 -0.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9713 -0.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0709 -2.7418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8679 -2.7326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3914 -0.8225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7820 -0.1277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -1.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1683 3.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7193 2.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4595 -1.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8905 -4.4122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4782 -3.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3240 0.9822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3240 2.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 4 14 2 0 0 0 0 4 19 1 0 0 0 0 5 13 1 0 0 0 0 5 22 2 0 0 0 0 6 15 1 0 0 0 0 6 24 2 0 0 0 0 7 21 1 0 0 0 0 7 24 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 16 2 0 0 0 0 14 15 1 0 0 0 0 15 17 2 0 0 0 0 16 20 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 23 2 0 0 0 0 20 38 1 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 24 41 1 0 0 0 0 M END $$$$