MMs00451514 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 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 1.3911 -0.5611 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7051 -0.6125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3945 -1.7716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1003 0.7710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6801 2.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5535 0.4164 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5143 1.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9186 -0.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1594 -0.7631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7594 -1.8023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9869 -1.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5729 -0.2609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7145 -1.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4427 -2.7090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -0.7317 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2794 0.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3998 0.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8132 1.2456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2696 -1.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9977 -3.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1393 -4.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5528 -3.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8246 -2.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6830 -1.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5672 -1.8146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9303 -1.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7541 -2.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2516 -2.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0755 -4.1480 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4489 1.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1129 0.4489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4489 -1.1129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0891 0.0912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0596 1.4919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5891 2.8204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6095 2.5792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9098 -1.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0842 -1.3237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1489 -2.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8015 -2.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1998 0.7527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2005 1.9268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0307 2.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8670 -3.5816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9219 -5.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4661 -4.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9554 -1.7738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9005 -0.0224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6692 -2.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2909 -2.9823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6539 -0.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0323 -1.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6521 -3.4562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0305 -4.1490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9752 -1.7268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3536 -2.4196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 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 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M CHG 1 2 1 M END