IFLAB-ZINC04292233 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4890 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.6300 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0090 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.7790 0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -3.6310 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -4.1630 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -3.6610 -1.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.8240 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.9150 -1.9450 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -2.4880 -3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -1.8240 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -1.0400 -3.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -2.1000 -5.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -1.4540 -6.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -1.9310 -8.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -1.2500 -8.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -1.6870 -10.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -2.8050 -10.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -3.4850 -9.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 -3.0460 -8.4470 C 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 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1010 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.3550 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -3.7080 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -3.8320 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -4.8730 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -3.5690 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -2.2310 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -2.7260 -6.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -0.3730 -6.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -1.7110 -6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -0.3770 -8.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -1.1550 -10.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -3.1470 -11.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -4.3590 -10.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -3.5750 -7.7450 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 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 29 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 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END