MMs00030674 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 65 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 0.7591 -1.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0183 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2591 -1.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0183 -2.5768 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6183 -1.5376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5182 -2.5663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2774 -3.8600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -1.2620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 -1.2514 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1590 -0.2122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5181 -2.5451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0181 -2.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7589 -1.2302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0635 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3998 1.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5372 1.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5084 2.5555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9670 1.9176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2122 1.0797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4453 1.9337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8015 1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9245 -0.2022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6914 -1.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3352 -0.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2436 -1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6960 -2.8742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2807 -0.8431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5593 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0471 -2.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6881 -1.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5963 -0.1227 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0366 -5.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6073 1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4409 -1.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0251 -2.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5743 -3.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0618 -3.1907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0424 -0.1029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3838 -0.8648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6517 -0.2270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3934 -2.9635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7348 -3.7254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8181 -3.7177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1486 -2.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3693 0.4554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6998 1.2361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1374 3.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3469 3.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7880 1.9760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7898 -2.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7364 -3.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6235 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8672 -0.9285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0016 -5.7822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6439 -6.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0716 -4.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2774 -3.8811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0775 -3.8896 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 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 61 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 44 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 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 27 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 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 51 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 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 61 62 1 0 0 0 0 M END