IBS-ZINC06662224 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -2.5650 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -3.8880 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -4.6600 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -4.4050 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -3.6330 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -5.7290 -0.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -6.2080 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2930 -7.5300 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -7.7540 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4180 -6.6140 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3400 -5.2340 -0.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 -6.5640 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4420 -7.8240 -0.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8470 -8.9530 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4020 -9.1120 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6420 -10.2150 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8580 -8.7370 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -8.6090 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -9.1490 0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -9.0040 -1.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -10.0780 -1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.9480 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -6.3460 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2500 -6.3820 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3000 -5.7680 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3940 -9.4590 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 -9.8290 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6330 -10.3690 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1880 -11.0750 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6700 -10.1000 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8870 -8.6220 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4050 -9.5970 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2910 -7.8380 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -9.7750 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -10.9690 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -10.2970 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 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 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END