MMs02290053 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 59 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 1.4999 -0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 -1.3175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7392 -1.3298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7605 1.2682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2606 1.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7604 1.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2604 1.2313 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6604 2.2705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1520 2.4376 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0005 3.2861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5747 1.9624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5624 0.4624 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6016 1.0624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1321 0.0106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7687 -0.4292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1990 0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0707 -1.1981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1791 -2.4044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7564 -1.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6334 -2.9237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9333 -4.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3560 -4.8686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4789 -3.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9016 -4.3493 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.8103 -5.3879 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.7002 3.8679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 4.9743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2612 6.4047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2740 7.5111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7386 7.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1904 5.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1776 4.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7514 8.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0098 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6308 -2.3517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3307 -2.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 2.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6691 2.3247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6362 1.6633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9785 2.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8338 3.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7671 1.8271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5792 1.1608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0895 6.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9125 8.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3621 5.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5390 3.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6366 7.4834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5617 9.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8662 9.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 51 1 0 0 0 0 35 52 1 0 0 0 0 36 53 1 0 0 0 0 36 54 1 0 0 0 0 36 55 1 0 0 0 0 M END