IFLAB-ZINC04392404 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0660 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2510 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -5.0130 1.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -6.3100 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -6.7040 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -5.2660 -1.4620 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -8.1300 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -8.6340 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -10.0210 -1.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -10.9440 -1.4520 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -12.2080 -2.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 -10.7850 -0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -10.2170 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -10.6140 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -10.0440 -4.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -9.0770 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -8.6800 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -9.2550 -2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9380 -8.3600 -5.2600 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -7.2950 1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5970 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -8.1810 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -8.7540 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -8.5840 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -8.0110 -1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -10.3980 -1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -11.3680 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -10.3540 -5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -7.9250 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -8.9480 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -7.5470 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -8.1990 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -6.8520 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END