COMGENEX-ZINC06687780 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.1310 -1.2120 0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -2.5620 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -3.6870 1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -4.9500 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -5.1050 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -3.9970 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -2.7360 -0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.5780 -1.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -0.7800 -1.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -1.4900 -2.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -2.4020 -3.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1850 -3.3990 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.8250 -4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -1.0190 -5.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.4650 -3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -0.2630 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 0.8430 -3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 2.0340 -3.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 1.8160 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.8600 -3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 3.2560 -4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 3.4150 -4.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 4.4350 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 5.8200 -3.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 5.1500 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -2.4540 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -1.4210 -1.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.7040 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -0.5820 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.3070 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -3.5870 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -5.8130 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -6.0850 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.1180 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -2.6030 -5.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -1.1850 -4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -1.2050 -4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 0.0000 -5.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 0.5350 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 1.0760 -4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.4290 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 2.7490 -2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 1.3530 -4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 0.6810 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 4.3810 -4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 5.9250 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 6.6460 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 5.5220 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 4.8030 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -3.5380 -2.6170 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 M CHG 1 50 -1 M END