MMs02593645 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.5000 -0.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2395 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4791 -2.6100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2187 -3.9150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7187 -3.9270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -2.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7395 -1.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4582 -5.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9582 -5.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 -6.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3552 -7.8874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2604 -6.0125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2724 -4.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8495 -4.0376 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4929 -3.6407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8583 -4.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0031 -5.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3685 -6.3758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5891 -5.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4442 -4.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0789 -3.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9340 -1.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5134 -7.8688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2928 -8.7407 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0096 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0096 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 1.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6308 0.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2792 -2.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6104 -4.9494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 -2.6437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3478 -0.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8499 -6.2664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3771 -2.4463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0267 -6.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6814 -6.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4207 -3.3133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1284 -1.7809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8182 -0.7024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7396 -2.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8787 -8.4898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 2 0 0 0 0 M CHG 1 25 -1 M END