MMs02470252 MOE2007 2D CORINA 3.40 0006 02.08.2006 88 89 0 0 1 0 0 0 0 0999 V2000 -0.9439 0.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4719 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6089 0.8132 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9195 -0.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3301 2.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -0.0126 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3929 -0.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2112 1.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7165 1.3901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6991 2.5881 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1007 3.0724 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2521 3.9209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3864 4.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2296 5.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7455 5.0965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9749 4.2723 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2855 5.4314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3398 4.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4988 6.4255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5513 3.9861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2823 2.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3949 1.5155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9114 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8586 -1.1434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4161 -0.1445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7800 -1.4877 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4695 -2.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2758 -1.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5392 -0.2905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4832 -2.7150 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3865 -3.9154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4699 -5.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0392 -4.6161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1377 -3.1075 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2892 -3.9560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -2.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8498 -3.7254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2351 -1.3229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6278 -2.7252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1233 -2.6098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9710 -3.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 2.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4028 6.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0459 1.9077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5099 0.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5272 2.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6494 3.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5475 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0765 0.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3402 -0.8023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1151 -1.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4007 -0.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5092 2.5101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1071 3.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 2.0640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6734 4.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7223 2.7411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6528 1.5040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0681 2.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4732 0.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8303 -3.5116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 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0 7.7162 0.9590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7122 2.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3382 3.3290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5066 4.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8096 4.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7922 2.8198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 51 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 53 1 0 0 0 0 5 54 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 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 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 42 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 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 2 0 0 0 0 23 25 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 26 39 1 0 0 0 0 28 29 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