COMGENEX-ZINC06837783 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 -0.8840 2.1090 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 1.0160 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 0.0360 -0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -1.0010 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -1.0840 -2.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -2.0300 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -3.1240 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 -3.8420 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -3.1420 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -2.0590 0.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -1.0610 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -3.5330 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3510 -5.0910 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 -5.0590 -0.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -6.4140 0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9340 -6.3590 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -6.7380 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6280 -7.4660 0.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6960 -7.7380 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 -8.1820 1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -7.8910 2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -9.3230 1.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8590 -10.1220 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7120 -11.1850 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1770 -11.4600 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7900 -10.6720 3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9320 -9.6100 3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0920 -12.6020 2.4240 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.4350 -13.2980 1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5030 -12.8470 3.5440 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.2680 -3.4960 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 2.8450 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 2.5970 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 1.6640 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 1.4610 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 0.5280 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -0.2730 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -1.5370 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -0.6320 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -4.1660 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 -2.6360 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -4.0800 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -5.9140 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -7.6500 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -6.8790 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 -8.5470 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6020 -8.0270 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -6.8410 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 -9.9080 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -11.8040 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1560 -10.8920 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -8.9990 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -4.0470 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1550 -4.1200 -2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -2.5910 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 31 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END