IBS-ZINC02397773 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 0.1210 0.4740 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.1380 2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 2.1500 3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 1.9520 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 2.2990 4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 2.0920 4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 1.5350 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 1.2060 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 1.4350 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 1.0890 1.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3050 0.0120 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 1.8700 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 3.3270 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 3.5990 0.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 4.1900 -0.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 5.5910 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 6.3320 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 7.7170 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 8.3290 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 7.5320 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 6.1840 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 10.0290 -0.8560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 5.5750 -1.4310 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.5840 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.7510 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 0.7040 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.3240 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 0.1020 3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 2.0230 4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 3.1740 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 2.7220 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 2.3510 5.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 1.3540 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 0.7610 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 1.4520 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 1.7890 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 3.8240 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 8.3080 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 7.9560 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.2940 1.3180 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4960 2.3030 1.0610 H 0 0 0 0 0 0 0 0 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 1 40 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 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 40 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 37 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 23 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END