MMs01245314 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7558 1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4884 2.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2442 1.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7442 1.3157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7557 -1.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2482 -1.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2469 -0.3001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5665 -2.8850 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2709 -3.6408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1207 -5.1333 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1517 -2.6421 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9396 -3.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1492 -2.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5222 -3.2060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7318 -2.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1048 -2.9230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2327 3.9071 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7327 3.9137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4769 5.2028 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5954 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9557 1.2904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6161 3.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1046 -1.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3396 2.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9046 -1.0219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5953 1.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2730 -4.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8065 -4.3188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2823 -1.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8158 -1.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8556 -4.2038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3891 -4.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5684 -0.8279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5360 -0.1182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END