IBS-ZINC04815454 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -2.5140 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -4.0780 2.7070 P 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -4.7300 1.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -4.2630 4.1860 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2330 -3.7830 5.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -3.6140 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 -2.2810 4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -1.6840 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5090 -2.4240 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 -3.7620 3.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 -4.3550 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7480 -1.8220 3.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 -0.4100 3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -2.6040 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -5.6510 4.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -4.7710 2.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -4.8870 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -5.5920 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -5.7160 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -6.4220 2.0600 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -1.7060 4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -0.6420 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -4.3410 2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 -5.3970 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3070 -0.3260 4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 0.0200 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0080 0.1260 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8120 -2.5320 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7980 -2.2150 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7440 -3.6480 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -6.1420 3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -3.8930 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -5.4660 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -6.5860 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -5.0130 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -4.7220 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -6.2960 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -7.4160 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -5.8420 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 -6.5100 1.2930 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 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 M END