CHEMBRIDGE-ZINC00350590 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9620 -1.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -2.8010 -1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -4.1020 -1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -4.0270 -0.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -2.7640 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -2.2030 0.0810 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -5.1570 -2.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -4.9150 -2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -5.8520 -3.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -3.6620 -2.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -2.5950 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -1.4650 -2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -3.4520 -3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -6.5370 -1.8110 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -2.1410 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -4.4170 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -2.9020 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -2.8810 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -6.8900 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -7.1720 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -6.5740 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 16 1 0 0 0 0 14 15 2 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M END