MMs00886158 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 0.7394 -1.3051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0212 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 -1.3174 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2271 -2.8173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2516 0.1826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7393 -1.3296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4786 -2.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9786 -2.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7392 -1.3541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2391 -1.3664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9785 -2.6715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2602 1.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7602 1.1949 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.5208 2.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9219 3.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4991 4.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1992 5.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3221 6.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7449 6.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0447 4.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3376 4.0970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4378 4.5761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0138 2.6324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0083 1.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5332 0.0868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5277 -1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9975 -0.7362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4726 0.6865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4781 1.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0441 0.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5915 1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 -0.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0555 -1.9895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6297 -3.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0131 -3.2065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8702 -3.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5701 -3.6911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 0.9853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9084 1.0074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4082 0.9706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2816 -1.2658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6239 -0.5053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 1.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4782 2.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6008 3.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0610 6.1880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0822 7.9782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6432 7.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3574 -0.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1476 -2.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7931 -1.6345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6484 0.9264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8582 2.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 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 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M END