COMGENEX-ZINC06871791 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 0.1110 1.2570 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.0840 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -0.5990 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.6790 0.7440 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 1.8220 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -1.9940 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -2.8290 0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -2.3520 -0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -3.7350 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -3.8880 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -3.6720 -2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -3.8110 -4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -4.1680 -4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -4.3840 -3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -4.2490 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -4.3050 -6.0720 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 -1.3570 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -1.2020 1.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7140 -0.9720 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 -0.1230 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6130 -0.7120 2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3370 -1.9640 2.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -2.3830 1.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 0.0210 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -0.6430 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5780 0.0470 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7620 1.3960 4.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 2.0600 3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9010 1.3800 2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7650 2.0670 4.8200 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 1.8140 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -0.6720 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 2.8630 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -3.9820 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -4.4070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9680 -3.3930 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -3.6420 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -4.6620 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -4.4210 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -1.6860 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -0.4000 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 0.0030 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 0.8230 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4140 -1.6940 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 -0.4650 5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0700 3.1120 3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 1.8970 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END