IBS-ZINC02128709 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.0780 1.7520 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 0.2880 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -0.2190 0.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2010 0.4590 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -1.6170 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -0.2790 -1.2590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3410 -0.8760 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -0.9100 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -0.2360 -1.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -2.2220 -1.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -2.8610 -1.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3780 -2.4140 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -4.3580 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -4.5640 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 -6.3390 -3.0920 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -6.3780 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -2.6620 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -2.0490 0.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 1.0770 -1.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 1.3620 -2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 0.5090 -3.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 2.7350 -3.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 3.1070 -4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 4.4040 -5.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 5.3330 -4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 4.9770 -3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 3.6770 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 3.2780 -1.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 3.9170 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 2.0110 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 1.7000 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 2.1610 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.8160 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 2.3210 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -0.3120 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 0.2040 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -1.5760 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 -1.9730 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -2.2980 0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -2.7440 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 -4.7880 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -4.8490 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -4.1340 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -4.0740 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -5.8430 -4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -7.4130 -4.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 -5.9030 -5.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 2.3860 -5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 4.6980 -6.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 6.3460 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 5.7070 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9250 -3.1660 0.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4120 -3.0120 0.9300 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 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 19 20 1 0 0 0 0 19 30 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 52 53 1 0 0 0 0 M END