IBS-ZINC04836918 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.7250 -0.4650 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.5270 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 0.2260 0.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -0.2490 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.4840 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 -2.2380 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -1.7560 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -1.9700 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -2.1220 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 -1.8680 -2.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4130 -2.6620 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -2.7960 0.8260 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4850 -3.8360 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9550 -2.3240 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -2.2710 2.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7340 -2.4600 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7730 -1.5600 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1170 -1.8060 3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0700 -0.9820 3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6810 0.0890 4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3370 0.3360 4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3830 -0.4940 4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8480 1.6810 5.7350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -0.0880 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.0800 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -1.5540 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 1.0840 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.3900 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 1.1870 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 0.3400 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -3.2000 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -2.3400 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1930 -1.9600 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -3.6350 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 -2.4880 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1400 -3.4660 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4210 -2.6430 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1200 -1.1740 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4260 0.7340 4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3340 -0.3040 4.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3650 -1.9430 1.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 -0.9880 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 15 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 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 42 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 42 43 1 0 0 0 0 M END