IBS-ZINC02122810 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -2.5650 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -3.8880 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -4.6600 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -4.4100 -0.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9880 -3.9780 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -4.0210 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4180 -5.8690 -0.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -6.5500 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 -6.0850 -2.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -8.0100 -1.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0870 -8.7400 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -9.4360 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -10.0010 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -10.8070 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -11.1680 -4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -10.7500 -5.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -9.9520 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -9.5760 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -8.8110 -3.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -8.3840 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -11.9520 -5.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -12.2960 -6.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -9.5730 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -9.1350 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -7.9640 0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -6.6960 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -6.3330 1.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -8.6930 -0.6480 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -1.9480 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 -4.4530 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -2.9360 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -4.3990 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -11.1330 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -11.0590 -6.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -9.6340 -6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -12.9220 -6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -12.8420 -6.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -11.3880 -7.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -10.6140 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -8.9490 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -9.9420 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -8.8740 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8170 -8.6340 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -9.7390 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5740 -8.1940 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END