IBS-ZINC02323715 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.1960 1.7440 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 0.2400 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.3470 -1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.7060 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.3980 -0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.2190 -2.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -3.6580 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -3.9950 -2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -1.6950 -3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -1.4100 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -3.5140 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 -2.8940 -5.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -1.7240 -5.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -1.5090 -7.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -2.5320 -7.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 -3.4290 -7.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -4.6900 -7.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -4.5240 -7.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -4.1780 -6.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -4.7390 -8.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -4.6460 -8.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -4.9790 -9.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -2.5320 -9.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -3.4330 -10.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 -1.3870 -9.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -0.3010 -9.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 0.6820 -9.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 -0.3960 -7.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 0.6680 -6.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 -1.2790 -11.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.1290 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 2.0130 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 2.2390 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -0.0160 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -0.1340 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -4.2020 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -3.9700 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -3.7420 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -5.0550 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -1.2000 -4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -1.3590 -3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -1.6720 -4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -0.3410 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 -4.6050 -4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -3.1600 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -5.0510 -8.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -5.4340 -6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 0.2580 -6.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 1.4780 -7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 1.0770 -6.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -0.4210 -11.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 -1.1000 -11.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -2.1770 -11.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -3.1940 -4.1010 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6510 -3.5160 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 54 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 11 54 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 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 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 22 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 25 30 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END