ASINEX-ZINC04945272 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.1670 0.1270 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -0.9660 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.6780 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.3800 2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.1170 3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 0.1730 4.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -0.2200 3.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -0.0560 3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -0.5330 1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.7610 0.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -0.5830 2.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -0.8770 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -0.9040 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7290 -1.9620 -0.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 0.3590 0.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 0.7200 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 2.0700 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7010 2.5210 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6880 1.6260 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 0.2680 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 -0.1710 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4690 -0.6970 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1410 -1.9190 -1.2840 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8760 0.2250 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -0.1070 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.0970 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.0760 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.9260 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.3190 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 -1.8390 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -0.0870 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 1.1190 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6480 2.7900 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9480 3.5690 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 1.9850 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8520 -1.2250 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6230 -0.2120 -1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 2 0 0 0 0 M CHG 1 23 -1 M END