IFLAB-ZINC04088585 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.9000 3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 1.9010 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 1.5620 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 1.6690 2.8560 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 2.1740 4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 2.2570 4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 2.6660 6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 3.8410 6.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 1.7400 6.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 2.4620 5.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 2.3490 4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7830 1.9940 3.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 2.6560 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 3.0640 7.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2920 3.3450 8.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6230 3.2260 7.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9360 2.8290 6.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9210 2.5470 5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3570 2.6970 5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3210 2.6130 7.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0280 3.7830 8.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6770 3.5360 8.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.1470 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.2250 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.0350 2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 1.4420 4.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 2.9240 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 0.8040 6.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 2.0110 7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 2.7460 6.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2450 3.1590 7.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0520 3.6610 9.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1670 2.2360 4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6110 3.5630 5.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4480 1.7940 5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3480 2.6790 6.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1750 1.6700 7.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9920 4.7130 7.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8070 3.8450 8.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7660 2.6940 9.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3840 4.4250 9.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 0.0650 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 1.6320 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 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 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END