COMGENEX-ZINC06690534 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -1.8390 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.9340 -0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 -2.3060 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -3.7500 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3390 -4.2540 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -4.0300 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 -3.3730 0.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -3.8850 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9350 -3.5700 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7480 -4.3060 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2090 -5.3550 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 -5.6660 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 -4.9420 1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -5.0120 1.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -5.9640 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -5.3800 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1830 -3.9790 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6520 -3.0690 1.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -4.2660 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -3.4720 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -4.0950 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 0.1090 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -1.6860 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3490 -2.7610 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8460 -5.9220 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 -6.4760 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -6.8980 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -6.1560 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -4.4460 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -5.1890 4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -6.0890 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -5.3210 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -2.4160 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -3.8400 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -3.5940 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -3.0390 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -4.6600 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -4.4620 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9720 -4.6900 2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9050 -4.4390 3.0200 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 28 1 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 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 47 48 1 0 0 0 0 M END