IBS-ZINC04295531 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.5420 0.1240 0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.4330 -0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.4150 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -0.7060 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -1.6900 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -2.4480 -1.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -0.9910 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.5530 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 0.4610 -2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 0.6190 -2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -0.4650 -2.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -1.1570 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -2.1120 -0.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -2.4830 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -1.9470 0.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 1.2500 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 1.2480 -3.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 1.9850 -4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 2.7260 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 2.7320 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 2.0030 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 0.7050 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 0.7680 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.6890 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -2.1720 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -1.8890 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 0.0510 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.2320 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 1.3240 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -3.2560 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.6700 -4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 1.9840 -5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 3.3020 -3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 3.3120 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 2.0120 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 3 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END