IBS-ZINC04026664 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 1 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 1.1590 -0.5940 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -2.0940 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7030 -0.5060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1770 -2.4020 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.1540 0.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7530 -2.2040 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -0.7270 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -3.1680 0.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7070 -2.9090 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -3.3170 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -4.4920 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -4.2160 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 -5.0350 3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7300 -4.4260 4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -3.0670 4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -2.2340 3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -2.8250 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -2.3140 1.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -1.3820 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -5.8180 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -5.7650 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -4.4400 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -4.1860 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -5.0100 -0.5250 O 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 2.0420 0.0270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -2.3520 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -2.4590 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -0.2390 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -0.7290 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -6.0950 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2150 -5.0260 5.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 -2.6430 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -1.1760 3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -6.1010 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -6.5700 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -6.5040 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 -6.0020 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M END