IBS-ZINC03984931 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 -0.0860 1.5940 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.0730 0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0630 -0.3110 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.4440 1.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1210 -0.0700 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -1.9910 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -2.4820 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -0.0140 1.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.2760 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 0.7140 2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.9530 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 0.7370 0.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 1.4440 1.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 1.7130 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 2.1820 2.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 1.4310 3.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 0.9570 3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 0.7620 4.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.6730 5.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9580 1.7130 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -0.4050 -1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -1.3780 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 2.0260 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 1.9130 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 2.0160 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 0.0660 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 0.1050 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 2.7490 5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 1.3280 5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 1.1630 5.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 1.4370 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1960 2.7820 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 1.1560 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -2.5720 2.2980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 34 -1 M END