IFLAB-ZINC04087818 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -3.1410 -3.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -4.0060 -4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -4.3090 -5.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -4.9330 -6.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -5.2300 -6.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -4.6220 -5.5680 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -5.9120 -7.8810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -6.3280 -8.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -6.1100 -8.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -7.0660 -9.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -7.4180 -10.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -8.6190 -10.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -8.9460 -10.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -8.0680 -11.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -6.8590 -12.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -6.5400 -11.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -5.9940 -12.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -4.7710 -13.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -8.3880 -12.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 -9.6460 -12.0530 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 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -6.0870 -8.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -7.9790 -9.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -6.4320 -10.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -9.3040 -9.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -9.8860 -10.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -5.6040 -11.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -4.2140 -12.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -4.1750 -13.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -4.9920 -13.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3350 -9.7770 -12.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -9.6720 -10.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -10.4500 -12.3170 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 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 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 39 1 0 0 0 0 18 40 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 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 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 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END