COMGENEX-ZINC06687920 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.6460 2.1390 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.8510 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -0.2450 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -0.0630 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 1.2370 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 2.3320 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -1.2480 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -1.3690 -1.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7110 -0.4630 -1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -2.5690 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -3.6620 -1.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -1.6690 -2.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -0.7360 -3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 0.4740 -3.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -1.3730 -4.6370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4820 -1.9990 -5.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.1690 -4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -1.9100 -5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.9260 -5.9100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.3970 -5.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -2.7120 -5.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -3.6400 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -4.4000 -4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -4.2100 -5.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -3.3040 -6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -2.5370 -6.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -3.2720 -7.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -4.2630 -7.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -4.8600 -5.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 2.9930 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 0.7000 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.2430 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 1.4000 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 3.3360 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9870 -1.1690 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -2.1680 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -2.6740 -2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -3.2270 -3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -1.7650 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -3.7820 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -5.1160 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -1.8290 -7.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 -3.7880 -6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 -5.0550 -7.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -2.3160 -0.5640 O 0 5 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 45 1 0 0 0 0 12 13 1 0 0 0 0 12 37 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 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 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 M CHG 1 45 -1 M END