MMs01727625 MOE2007 2D CORINA 3.40 0006 02.08.2006 85 88 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 0.7403 1.3046 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4597 1.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2402 1.3158 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6402 0.2766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2401 1.3382 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4805 2.6316 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8805 3.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9805 2.6204 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2208 3.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7209 3.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0194 2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6194 3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5194 2.5868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4819 2.5569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2207 3.9362 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8207 4.9755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7207 3.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4804 2.6540 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0804 3.6933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7401 1.3494 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7521 0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1178 0.8626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1178 -0.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9499 2.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0571 3.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7343 4.8300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8414 5.8420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5186 7.3068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6258 8.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0558 7.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3030 9.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4871 2.9123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8099 1.4474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4224 0.1223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4336 -1.3777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7382 -2.1179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1402 -2.1373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6728 -0.1491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 5.2296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 -0.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0437 0.5922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5922 -1.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0437 -0.5922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8754 -0.3964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2171 -1.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3003 -1.1497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0652 -0.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3454 4.3327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0036 5.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9204 5.0859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4098 4.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1271 3.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 3.7558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8824 2.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5327 1.3579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5035 5.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8452 4.3663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2693 -0.1140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 -0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 4.3722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0908 5.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4849 4.8291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9507 6.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3746 7.6691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6935 6.7220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1998 7.5037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4181 9.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4749 10.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0447 10.9556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1311 9.5254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8364 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1055 -2.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7480 -3.1721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0734 -0.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6189 -1.3478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8716 -0.2029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0533 6.2733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 -0.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8212 -1.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1489 0.0025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5943 3.9243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7383 3.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 55 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 20 21 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 37 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 35 1 0 0 0 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