IBS-ZINC05457957 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 2.6800 -2.7130 3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -1.9420 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 -1.2530 2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -1.3350 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -2.1100 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -2.7970 2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -0.6580 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 0.1660 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9660 -0.3670 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0640 0.4700 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 1.8460 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 2.3790 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.5410 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 2.6960 0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1030 2.3770 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1620 1.3180 -1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2630 3.3370 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5820 2.6280 -1.7040 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7740 3.9200 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6220 5.0370 -0.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3610 3.1970 -2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7290 5.8080 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6250 5.1000 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9990 3.9070 -2.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8550 5.6590 -2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1560 6.9100 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2300 7.5550 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0670 7.0060 -0.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -3.2540 4.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -1.8770 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 -0.6500 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 -2.1760 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -3.4000 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -1.4370 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0600 0.0550 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 3.4490 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 1.9560 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 3.5130 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9330 4.2790 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6380 3.5160 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5610 5.1350 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1050 7.3760 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4660 8.5290 -0.4740 H 0 0 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 28 2 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 M END