MMs03082294 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 61 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 1.5000 -0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2575 1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2424 -1.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7424 -1.3209 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9424 -1.3209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7575 1.2771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7575 1.2596 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3575 0.2204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0151 2.5630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7726 3.8577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0302 5.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2726 3.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2574 1.2509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0150 2.5455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0525 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0612 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8998 -1.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2422 -1.3646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7422 -1.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4846 -2.6768 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9846 -2.6855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2574 1.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7574 1.2247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4848 -2.6243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7272 -3.9189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2272 -3.9102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4696 -5.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2933 0.6798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8636 2.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2218 1.8919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1124 -1.7160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4439 -2.4951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5938 -1.0777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0913 1.7971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1003 3.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3726 4.8969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0729 5.7550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4363 6.2038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9875 4.5671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2656 2.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4726 3.8419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2796 5.0489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3938 -1.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1122 -1.7685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4437 -2.5476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5407 -0.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8722 -0.9695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9776 -3.8855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1846 -2.6925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9916 -1.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6635 2.2761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6847 -2.6313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4269 -5.8162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0635 -6.2650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5123 -4.6284 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 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 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 40 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 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 M END