IBS-ZINC04025523 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 0.0200 -0.6160 1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6720 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1360 -1.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6220 -2.4980 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -2.6340 -2.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0480 -2.2290 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -4.1620 -2.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9300 -4.5160 -3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -4.6290 -2.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4930 -4.3010 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -6.1610 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -6.5750 -1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -6.1270 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -4.6990 -1.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -6.5950 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -6.7100 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -4.0800 -1.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.6690 -1.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8310 -2.3500 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -2.1600 -2.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -2.4100 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 -1.8240 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 -2.0880 -3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 -1.1720 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9890 -1.4130 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 -2.5710 -2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7440 -3.4870 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 -3.2440 -3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -2.2020 -2.5940 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 -0.0140 -0.1820 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -6.5070 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -6.5800 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -7.6830 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -6.2530 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -6.1800 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -6.3780 -3.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -6.3690 -2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -7.7990 -2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -3.4850 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -1.9430 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -0.7500 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -2.2920 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 -0.2670 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6140 -0.6980 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6010 -2.7600 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1770 -4.3920 -3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 -3.9570 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -1.2420 -2.5750 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 4 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 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 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END