IBS-ZINC05208518 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -0.7920 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -0.7090 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -0.3140 -2.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -1.0710 -3.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -1.0150 -4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 -1.5090 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -1.8270 -3.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -1.6040 -1.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -1.2460 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -1.2320 0.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.8040 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -0.6700 2.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -1.0050 3.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -0.8790 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -1.2310 5.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -1.0960 7.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -1.4270 8.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8080 -1.8950 7.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 -2.0300 6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -1.6960 5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -2.2200 8.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9480 -2.6950 8.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7320 -3.0040 9.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -2.0220 10.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2270 -2.3060 11.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1720 -3.5700 12.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3980 -4.5520 11.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6820 -4.2700 10.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -2.0870 -1.0160 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -0.3430 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -0.5150 4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -0.7330 7.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -1.3230 9.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2230 -2.3940 6.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7120 -1.7980 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 -1.9290 7.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 -3.5990 7.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5500 -1.0340 9.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8310 -1.5390 11.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7340 -3.7920 12.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3560 -5.5400 11.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -5.0380 9.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 -2.3180 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -2.9860 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -1.3160 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 12 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END