IFLAB-ZINC04570704 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 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 0.0230 -0.7010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8190 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.1140 -2.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.5950 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.6890 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.0850 -4.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -6.0760 -4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -6.7130 -3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -8.1530 -3.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -9.0380 -3.3540 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -10.3840 -3.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -8.3250 -3.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 -9.0000 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -9.9720 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -9.9470 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 -8.9450 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -7.9660 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -8.0010 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -6.9800 0.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 -6.0100 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -8.9180 2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -9.9540 3.2410 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 0.0250 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -3.9030 -5.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -6.5270 -3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -6.2440 -5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -6.2630 -3.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -6.5450 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -8.5880 -4.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -10.7530 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -10.7070 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -7.2450 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 -6.5060 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -5.4990 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 -5.2830 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -9.9150 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -10.9230 2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 -9.8160 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 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 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END