MMs01987360 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 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 1.5000 0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2434 1.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4869 2.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0131 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7565 1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4837 4.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7253 4.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9433 4.0345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0827 4.4110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9126 4.4786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2319 5.9443 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5424 7.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1222 6.9536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4414 8.4192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6608 6.4006 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7704 5.3913 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7611 4.2817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7797 6.5010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8801 4.3821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5608 2.9164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6705 1.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0994 2.3635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4186 3.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3090 4.8384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6282 6.3040 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5186 7.3133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0571 6.7604 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5948 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1052 -1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4434 1.3164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9565 1.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7193 6.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0737 3.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1117 4.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9161 7.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4177 2.5513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4151 0.7346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9871 1.5561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5618 4.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3067 6.4972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1944 7.3046 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END