IBS-ZINC00532104 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -9.0840 3.1170 -3.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6230 2.9300 -4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7060 2.4430 -3.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 2.9940 -5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 2.4140 -3.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 2.8930 -5.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 3.2140 -5.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 1.8490 -3.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 1.5270 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 2.2720 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 2.1610 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 2.1600 0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 2.0560 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 1.9510 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 1.9510 3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 2.0500 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 2.0440 1.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 1.8130 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 1.2330 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 3.1340 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 0.4540 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 0.1470 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2400 4.1120 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6720 3.0070 -4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3960 2.3660 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 2.9460 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 2.2420 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 2.0550 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 1.8700 4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 1.8700 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 1.1080 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 1.9380 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 1.0570 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 0.2920 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 2.9570 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 3.8390 3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 3.5460 4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1070 -0.1930 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7360 -0.8920 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 38 39 1 0 0 0 0 M END