IBS-ZINC04038000 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1580 -2.5360 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -2.6520 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -2.2510 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.7370 -3.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -3.3420 -3.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -2.4980 -4.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -2.9960 -6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.6580 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.9230 1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -3.9220 1.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.3680 2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -3.6310 3.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -5.6320 3.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -6.1170 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -7.5500 4.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -8.5770 4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -9.8920 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -10.1790 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -9.1520 5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -7.8380 5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.2040 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.7370 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 -2.7000 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -1.1660 -2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.5460 -6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -4.0800 -6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -2.7360 -7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -4.5100 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -6.2200 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -6.0540 4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -5.5040 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -8.3530 3.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -10.6940 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -11.2060 5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -9.3760 6.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -7.0350 5.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 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 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END