IFLAB-ZINC04075884 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 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 1.1950 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 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -4.8060 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9310 -4.3840 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -6.3160 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -6.9390 0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -6.8980 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -6.1420 -2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 -6.5950 -3.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -7.9450 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -8.4690 -3.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -9.8280 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -10.6750 -3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -10.1590 -3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -8.8000 -3.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -12.0150 -3.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -12.8290 -3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -4.4350 -1.5880 S 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 0.0160 -2.6060 -2.1450 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 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -7.8660 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -7.8100 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 -10.2340 -4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -10.8220 -3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -8.3990 -2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -12.5260 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -12.7090 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -13.8740 -3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 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 9 24 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 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END