IBS-ZINC02262384 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -0.5580 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -1.9610 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -2.6920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.0330 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.7500 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -4.1740 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 -2.6050 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -1.8770 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -2.7300 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 -4.1040 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1710 -3.9630 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -5.0390 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -6.2520 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 -7.4090 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -8.6370 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -8.7700 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9620 -7.6740 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -6.3870 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1770 -5.3020 0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5130 -2.3440 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1080 -2.1720 -0.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1500 -2.1680 1.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5240 -1.7790 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 -0.5010 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8630 -0.0160 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 0.1900 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 1.4060 0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.7710 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -4.6240 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -7.3230 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -9.5220 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 -9.7560 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0360 -7.7920 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6100 -0.8280 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0950 -2.5410 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9150 -1.6720 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 M END