IBS-ZINC05111219 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 58 0 0 0 0 0 0 0 0999 V2000 2.5770 -1.4000 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -2.8410 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -3.2750 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.7260 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -5.1590 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -6.6110 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -7.0240 -0.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -6.8080 -1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -6.2740 -2.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 -7.2620 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 -7.1260 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -6.5830 -3.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 -6.4850 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7550 -5.7200 -6.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8130 -5.6400 -7.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -5.6720 -9.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -4.7790 -9.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4160 -4.1910 -9.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8700 -2.9110 -8.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 -7.8780 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -8.2740 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -7.9800 0.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -7.5900 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -7.7480 1.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -1.1110 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -0.7170 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -1.2690 1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -2.9450 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -3.4940 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -3.1650 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -2.6170 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -4.8350 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -5.3840 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -5.0470 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -4.4990 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -6.7240 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -7.2730 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 -7.4700 -2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -6.2350 -3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 -7.4930 -5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1750 -5.9720 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 -4.7090 -5.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -6.2120 -6.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 -6.6270 -7.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7030 -5.1300 -6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -6.2230 -9.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -6.3910 -8.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 -4.0520 -10.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -4.2300 -9.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 -5.3870 -10.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 -4.9240 -9.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0380 -3.9550 -10.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -2.2020 -8.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6530 -2.4310 -9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 -3.0970 -7.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 -8.3940 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -4.8370 -8.3010 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7140 -4.0740 -7.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 57 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 57 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 2 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END