IBS-ZINC02405590 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3920 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9100 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -2.2370 -2.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6850 -1.7310 -3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -3.7260 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -4.3440 -4.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -1.7830 -4.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.6920 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -1.4910 -5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -1.6050 -5.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -1.0730 -6.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -0.7560 -7.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 0.2380 -8.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 1.4440 -8.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 1.0610 -9.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 0.2090 -9.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -1.2130 -10.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.6760 -9.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -2.0370 -8.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.0240 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.0400 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.3260 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3420 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -0.9820 -6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -0.3140 -7.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.2460 -9.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 0.5690 -7.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 2.2650 -9.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 1.7560 -7.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 0.4910 -10.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 1.9650 -10.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 0.6440 -9.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 0.1820 -8.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -1.2270 -11.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 -1.8820 -9.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -0.8730 -10.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -2.5500 -10.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -2.6210 -8.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -2.6230 -8.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -4.3650 -2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -5.3200 -2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 45 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 45 46 1 0 0 0 0 M END