IBS-ZINC01868681 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.0630 1.4900 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 0.1050 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -0.5890 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 0.0980 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 1.5000 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 2.1900 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 2.2420 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 1.5970 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 2.3020 -0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 1.6330 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 0.4160 -0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5200 2.3750 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7680 1.8190 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6510 2.8420 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8990 4.0260 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6500 3.7130 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0470 2.7400 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9890 3.8630 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2010 3.3810 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1060 1.9680 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7300 1.6310 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6480 5.2110 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0970 0.3480 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1860 -0.1400 1.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4810 -1.4740 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5750 -2.3750 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8680 -3.7000 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0700 -4.1440 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9800 -3.2660 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6900 -1.9200 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -0.9730 3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2430 0.1730 3.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9120 -1.3790 5.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -0.5830 -0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 2.0230 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.4360 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -1.6690 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 3.2700 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 3.3220 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 3.2720 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7150 5.4760 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3440 5.8870 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 -0.1960 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0510 0.1920 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0400 0.4690 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4190 -2.0370 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9400 -4.3960 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2980 -5.1840 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 -3.6180 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1960 -2.2930 5.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8520 -0.7560 5.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 -0.7730 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 21 2 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 20 21 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 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 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 34 52 1 0 0 0 0 M END