MMs03303107 MOE2007 2D CORINA 3.40 0006 02.08.2006 89 95 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 1.4293 0.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 1.9203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -0.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9674 -0.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0760 -1.1108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5054 -0.6558 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6568 0.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 0.8095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6141 -1.6662 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5748 -2.2662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4483 -3.1570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 -3.7753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8253 -2.6666 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1359 -3.8257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0831 -1.3631 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4831 -0.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8409 -0.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3409 -0.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0831 -1.3811 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.6831 -0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3253 -2.6756 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5253 -2.6756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0675 -3.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5675 -3.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3252 -2.6936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5830 -1.3901 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.7830 -1.3901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3408 -0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8408 -0.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5830 -1.4081 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.1830 -2.4473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8252 -2.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0830 -1.4170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8407 -0.1225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3407 -0.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0829 -1.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5829 -1.4440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3407 -0.1495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5984 1.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0985 1.1630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3563 2.4665 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.8563 2.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0985 1.1810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5986 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 2.4935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6141 3.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1141 3.7790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 1.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1435 -0.3640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -1.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5808 1.3035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9223 1.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0065 3.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5777 2.1768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -1.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -1.6183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4104 0.9625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 0.6327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -1.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -2.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9983 0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 1.9818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6538 1.0660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2761 -2.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0707 -4.2960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2087 -4.8109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7815 -4.4864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7157 0.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0563 1.1119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1396 1.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4709 0.3261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9374 -4.3828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2688 -5.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1612 -5.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2157 0.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5563 1.0849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6395 1.0785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9709 0.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6098 -3.8831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9504 -3.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4767 -2.4706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1766 -2.4868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5406 -0.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2047 2.1896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2954 0.6722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6564 2.5007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0204 4.8308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7203 4.8146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 3 53 1 0 0 0 0 3 54 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 56 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 5 58 1 0 0 0 0 5 59 1 0 0 0 0 6 7 1 0 0 0 0 6 60 1 0 0 0 0 6 61 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 62 1 0 0 0 0 9 63 1 0 0 0 0 9 64 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 65 1 0 0 0 0 12 66 1 0 0 0 0 13 14 1 0 0 0 0 13 67 1 0 0 0 0 13 68 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 69 1 0 0 0 0 18 70 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