IBS-ZINC02421730 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -1.9250 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -2.3390 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -3.8660 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 -4.2630 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -4.4400 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -4.7930 -1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -5.0020 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 -4.8350 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -4.4570 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 -4.3070 2.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4170 -5.1260 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -5.4560 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3440 -5.3700 0.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3200 -5.6360 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2700 -7.1170 -1.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.4060 -7.7330 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3730 -7.4320 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6040 -7.9850 -3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -8.4320 -2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0070 -7.4210 -1.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7010 -5.7680 2.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6850 -5.7740 3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8400 -6.1040 4.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8020 -6.1040 5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6310 -5.7800 6.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4940 -5.4550 5.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4950 -5.4450 4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -5.1290 3.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 -4.2200 -2.4410 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 -0.9520 -2.3160 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -2.3260 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -1.9480 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -1.9380 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -4.2570 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -4.2670 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3200 -5.3860 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0840 -5.0280 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0580 -8.1840 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9150 -6.5250 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1280 -8.8350 -3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4420 -7.2050 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3640 -9.4120 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 -8.4400 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7550 -6.3570 3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6910 -6.3580 6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6270 -5.7870 7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5950 -5.2060 6.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -5.1560 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -3.8760 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -3.4680 -2.2930 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 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 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 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END