IBS-ZINC02382942 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1230 3.9400 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 2.5700 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 2.4260 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 1.1740 2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 0.0420 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 0.1780 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 1.4460 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 1.6000 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 1.0590 -2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 1.4460 -3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 2.2190 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 2.2920 -2.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 2.8220 -4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 2.6850 -4.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 1.7410 -3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 1.7020 -3.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 3.6440 -5.6560 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 2.4240 -6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 2.6680 -7.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -0.4180 -7.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 1.5390 -8.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 0.5320 -7.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 1.1250 -6.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2860 1.3930 -9.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -1.2970 2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.2800 1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 4.3720 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 3.8610 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 4.5800 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 3.2980 2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 1.0700 3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -0.6930 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 0.4460 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.1920 -4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 3.3930 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 1.3650 -10.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8600 0.4680 -9.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9680 2.2400 -9.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.9140 -2.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.4270 3.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -2.3230 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 0.3280 -2.2910 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 21 2 0 0 0 0 20 22 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 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M END