IFLAB-ZINC04291551 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -1.0110 3.0820 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.6120 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.8810 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.5900 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -1.3210 2.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0230 -0.8080 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -2.7370 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -3.6620 2.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -1.3330 3.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -0.7730 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -0.2330 4.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -0.8370 5.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.3420 6.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 0.1670 6.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 1.2860 7.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 1.5520 7.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 0.6860 6.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -0.5370 6.2320 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -1.7070 5.2560 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -1.9070 3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -2.6790 2.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 3.5410 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6700 3.6030 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 3.1500 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 1.1520 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.5440 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.3400 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 0.9480 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -1.0490 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.6570 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.3390 7.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 1.8970 8.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 2.3980 8.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 0.7510 6.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -2.9710 0.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -3.8960 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 35 36 1 0 0 0 0 M END