IBS-ZINC02285892 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 69 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.4190 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -0.0260 -3.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -1.3820 -3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -2.2950 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -1.8510 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -2.7470 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -3.7720 -2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -3.9890 -4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -4.4030 -1.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -4.4260 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.9680 -4.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 1.3180 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 2.3120 -4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 2.7020 -5.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 2.7680 -4.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 3.7340 -5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 4.0850 -5.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1840 5.0790 -6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9120 4.7980 -7.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2310 5.9550 -8.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7510 6.0060 -8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7020 7.0360 -7.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0180 6.5340 -6.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 7.4120 -5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4030 8.7560 -5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 9.2560 -6.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 8.4080 -7.6490 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 0.2320 -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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.4780 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -1.7270 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -3.0180 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -3.5230 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -5.0570 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -3.5390 -4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -4.2490 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -5.4720 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -3.9380 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -3.9760 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -5.4940 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -4.2720 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.5340 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 1.8710 -4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 1.7520 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.4150 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 2.4560 -4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 3.3000 -6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 4.6380 -5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6560 4.5190 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2440 3.1810 -5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2020 3.8070 -7.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 7.0300 -4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 9.4350 -4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0890 10.3200 -6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2420 8.8060 -8.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 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 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 23 1 0 0 0 0 22 61 1 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 30 31 2 0 0 0 0 30 65 1 0 0 0 0 31 32 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 M END