COMGENEX-ZINC06869021 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0170 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -0.7040 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -2.0330 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 -2.6720 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -2.0210 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -4.4340 -0.0650 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -4.7380 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -6.2230 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -6.9080 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -8.2670 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -8.9520 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -8.2550 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -6.8950 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -10.4080 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -11.0120 0.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 -0.0450 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 -1.0020 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7500 -0.2340 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8280 0.6720 0.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 1.6180 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 0.8690 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 1.0970 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -4.2970 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -4.2880 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -6.3770 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -8.8000 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -8.7790 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -6.3540 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4030 -1.6040 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -1.6520 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5820 -0.9370 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7980 0.3250 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 2.2550 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7750 2.2320 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 1.5850 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3840 0.2970 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -11.0660 -1.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -12.0170 -1.1910 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 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 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 49 50 1 0 0 0 0 M END