IBS-ZINC02130197 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -0.0910 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -0.4180 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -1.0500 -3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -0.0080 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -0.3500 -3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 0.0430 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 -0.1230 -4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9180 -0.7420 -5.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1650 -0.7250 -5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 -0.0930 -5.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0490 0.5230 -4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 0.5170 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3420 1.0450 -2.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 1.5380 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0040 0.7730 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 1.0770 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 0.6880 -1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 1.8450 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 1.6620 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 2.3780 1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3510 3.2800 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 3.4670 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 2.7560 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 4.3980 2.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 5.0760 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 4.0940 3.4680 O 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 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.5840 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 0.4130 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -0.9120 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0940 -1.2360 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3160 -1.2060 -6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1990 -0.0850 -5.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8820 1.0120 -3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 0.9600 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2080 2.2350 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 2.9030 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 5.9520 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 5.3600 4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 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 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 2 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 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 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END