COMGENEX-ZINC04455376 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5720 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -2.4260 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -3.7590 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -4.0240 0.0280 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -2.3420 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -1.6870 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4590 -1.7140 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 -1.5040 -1.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6750 -2.5510 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1700 -2.3510 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5960 -1.1240 -2.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9840 -0.8400 -2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 -0.3460 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 0.5240 -1.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 -0.1360 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 1.0220 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2820 1.2330 -5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 2.4330 -6.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 2.6230 -7.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1490 1.6310 -7.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4340 0.4410 -7.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 0.2330 -6.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6120 1.8430 -9.3330 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.3630 2.8900 -9.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2430 0.9720 -9.9050 O 0 5 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 -2.3460 -4.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 -2.3730 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -0.7560 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4800 -2.4980 -3.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3700 -3.5280 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 -3.1800 -2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3530 -2.3160 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5800 -1.6370 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2050 -0.7740 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2280 0.1070 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6580 -0.9080 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 1.7940 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4390 3.2080 -5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2130 3.5490 -7.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9940 -0.3290 -7.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2210 -0.6980 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END