IBS-ZINC02111819 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0210 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.1140 -2.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -0.6120 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -0.2610 -3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 -0.6640 -4.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 0.4680 -4.8210 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 0.6070 -6.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.0520 -7.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 0.3690 -6.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 0.2960 -7.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -0.1580 -9.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -0.0760 -9.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 0.4320 -9.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 0.8850 -7.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 0.8140 -7.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 1.1670 -5.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 1.5500 -5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 0.8990 -5.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.1440 -4.5930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5260 0.6770 -3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 1.0340 -3.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 2.6470 -4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -0.5050 -11.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -0.4000 -11.5640 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -2.3720 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -2.3060 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -2.4690 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -1.6960 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -0.1830 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 0.1150 -6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 1.6640 -6.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -1.1360 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 0.2630 -8.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.5530 -9.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 0.4740 -9.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 1.2780 -7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 2.8320 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 3.1610 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 3.0200 -5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -0.9890 -10.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -0.7750 -12.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 0.6440 -11.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 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 26 1 0 0 0 0 24 25 2 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END