MMs00028057 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 0.7443 -1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0113 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 -1.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2443 -1.3219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4886 -2.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9886 -2.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7443 -1.3285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6312 -0.1188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1739 1.3098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0558 -0.5885 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0558 0.6115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3581 0.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6538 -0.5999 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6538 0.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6473 -2.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3450 -2.8442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0492 -2.0885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6206 -2.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1509 -3.9704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9561 0.1445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2519 -0.6112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2453 -2.1112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5542 0.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8499 -0.6225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0002 -2.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4661 -2.4332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2217 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2229 -0.0184 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0418 0.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5955 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0418 -0.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4045 1.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1045 1.0170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0841 -3.6595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3841 -3.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5907 1.0784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1334 1.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8300 -1.8966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0528 -3.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1123 -3.7668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5696 -3.7601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9614 1.3445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7869 1.0557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3295 1.0490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1050 -2.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9494 -3.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4157 -1.0173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 21 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 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 M END