IBS-ZINC02094584 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 1.5310 -3.9380 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -4.3300 3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -5.8540 3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -6.2290 5.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2890 -7.5300 5.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -8.3900 4.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -7.9150 6.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0400 -7.4940 6.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -7.4260 7.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -8.6700 8.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -9.8280 7.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -10.9940 7.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -9.3760 6.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 -10.2300 5.9820 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5730 -9.6340 5.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 -10.9130 6.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 -10.4490 7.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 -11.3450 8.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 -12.7070 8.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 -13.1830 7.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 -12.2860 6.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -12.4770 5.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -13.5550 5.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -11.2860 5.3070 O 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 0.5240 -4.3550 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -4.3290 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 -3.9130 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -3.9390 4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -6.2710 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -6.2450 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -5.5410 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -7.1770 8.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -6.5770 7.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -8.7780 9.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -8.6030 7.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -9.3870 7.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4020 -10.9800 9.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 -13.4010 9.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3790 -14.2470 7.4140 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 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 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 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M END