IBS-ZINC02221928 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -4.0490 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -4.6150 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -3.7780 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.3930 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -4.6610 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -5.9740 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -5.9290 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -6.7060 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -7.0220 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -6.7250 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -5.4720 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -4.4560 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -8.3420 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -9.2620 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -10.7040 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -10.9670 -1.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -10.0470 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -8.6040 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -12.3000 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -12.8060 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -14.1230 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -14.9380 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -14.4390 -2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -13.1220 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -12.6330 -3.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7690 -13.5340 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 -12.8090 -5.3680 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -2.2480 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -4.6850 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -1.7470 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 -5.2740 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8970 -9.0560 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8530 -9.1230 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -10.8500 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 -11.3890 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -10.1850 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -10.2520 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -8.4580 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -7.9190 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -12.1720 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -14.5170 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -15.9660 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 -15.0780 -3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -13.8900 -4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -14.3810 -3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 -12.4520 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -11.9620 -5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -13.4960 -6.1860 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 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 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END