IBS-ZINC06665214 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0900 -0.7690 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -2.0940 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -3.4100 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -4.2030 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -3.3870 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -2.1260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.8300 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -0.3960 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -0.2380 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 0.2160 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 0.3670 -2.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5580 -0.6010 -3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -0.0380 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 1.2380 -4.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 1.4900 -3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -5.5830 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -6.1330 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -7.3440 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -5.3770 -0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -4.0300 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.3580 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -6.0260 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -6.2410 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -5.2660 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -5.4630 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -6.6350 -4.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -7.6100 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 -7.4150 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -6.4410 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -0.4170 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -1.1410 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 0.5590 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 0.5080 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 -1.1920 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -0.5300 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 1.1710 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 -1.6200 -3.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3230 -0.5290 -5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 2.4390 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -5.3920 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -6.9880 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 -4.3500 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -4.7010 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -6.7880 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -8.5250 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -8.1780 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -6.6480 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -7.3780 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -5.9360 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END