NCID-ZINC05541312 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2150 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.5930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 4.0950 1.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3220 3.6440 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 5.5950 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 6.3000 1.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 6.1530 1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 7.6110 1.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3570 8.0420 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 7.9800 1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 7.5410 3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 7.9040 3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 8.4580 2.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 8.1520 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 7.3970 -0.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.0770 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -2.7890 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -3.0440 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -3.9200 1.3800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.8300 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -3.0850 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -4.0120 -1.4410 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -0.4880 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 3.9730 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 3.9440 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 5.5900 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 9.0590 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 7.4770 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 6.4620 3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 8.0440 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 2.7210 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -3.7410 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -2.1850 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -2.0920 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -3.6480 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -3.7830 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -2.2560 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -2.1320 -1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -3.6590 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 7.6130 4.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 9.4720 -0.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 3.7240 2.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 4.1300 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 9.7720 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 7.8660 5.0880 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 50 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 39 50 1 0 0 0 0 48 53 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END