ASINEX-ZINC04892331 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0090 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4060 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 2.1030 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 3.3930 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 4.0880 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 5.4870 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 6.1840 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 5.4990 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 4.1080 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 3.4030 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3060 6.2080 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4590 5.2960 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7500 6.1140 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7920 7.0210 0.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6850 7.9250 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3830 7.1250 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 -0.7220 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6910 -1.9400 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -0.1060 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7660 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 6.0190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 7.2640 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 3.5800 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 2.3230 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4570 4.6920 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3950 4.6440 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6090 5.4440 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7770 6.6770 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7740 8.5650 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6810 8.5400 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 7.8080 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3640 6.5510 2.0340 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 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 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END