IFLAB-ZINC04315883 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0150 1.3790 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0040 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0330 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4260 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0920 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.6880 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 -0.1180 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 -1.1430 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 -1.0520 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1450 -2.3120 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -2.0350 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 -3.9280 -0.0890 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -4.9260 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 -6.4110 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -7.2180 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -8.5640 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -9.1060 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -9.3870 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -8.8450 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -10.7320 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -11.5030 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -11.0660 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -11.8300 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -13.0290 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -13.4670 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -12.7110 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5560 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9840 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1720 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 0.9390 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 -4.7030 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -4.6930 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 -6.6340 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -6.6440 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -6.7850 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -11.1660 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -10.1300 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -11.4910 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -13.6250 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -14.4030 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -13.0550 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 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 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END