IFLAB-ZINC04357234 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0460 1.5390 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 0.0090 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -0.5020 0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -1.8310 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.6040 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -2.3530 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -1.5800 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -3.6820 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -4.1930 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -5.7230 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6050 -6.1060 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -6.2100 1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -7.6440 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -8.0560 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -7.6030 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -6.1850 -1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -5.1730 2.3050 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -5.2700 2.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -3.9490 2.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -5.8110 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -6.6930 4.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -7.1950 5.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -6.8120 6.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4030 -5.9260 5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -5.4230 4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -7.3040 7.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2860 -6.8660 7.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 1.9190 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.9000 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 1.8870 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -0.3400 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.3520 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 0.1160 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -4.3000 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 -3.8450 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -3.8320 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -7.8240 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -8.2190 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -7.5820 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -9.1400 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -7.8770 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -8.0880 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -6.9920 4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -7.8850 6.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -5.6260 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -4.7300 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 -7.3330 8.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -5.7820 8.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0590 -7.1490 7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 6 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END