IBS-ZINC05345516 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 55 0 0 1 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 0.7410 -0.5150 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -2.0260 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.7060 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -4.2160 0.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6850 -4.5840 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -4.7350 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -6.0530 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -7.0610 0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -8.1220 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -7.8000 0.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -6.4750 0.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -5.6340 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -4.4090 1.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -3.9360 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -2.6590 1.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -9.4440 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -10.5280 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -11.5630 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -11.0650 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -9.7870 -0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -4.7020 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -5.4950 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -5.9180 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -5.5380 3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -4.7830 4.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -4.3670 3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -2.0410 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -2.6900 -0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5390 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -0.5020 -1.2610 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 1.7720 -0.1600 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.1420 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -5.9660 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -10.5840 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -12.5650 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -11.6060 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -5.7760 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -6.5370 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -5.8640 4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -3.7530 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -0.1390 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -0.2390 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.1260 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -1.5920 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.1420 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 16 2 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 M END