IBS-ZINC00122982 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 1.0200 1.6130 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 0.1260 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -0.6920 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -2.0750 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -2.6640 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -1.8420 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.4580 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -4.0790 -0.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -4.8830 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -6.1880 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -6.0840 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -4.8320 0.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -7.2120 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -6.8380 -2.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -5.5430 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -4.5050 -2.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -8.5560 -1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -9.7130 -1.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -9.6890 -2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -10.8680 -3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -12.1130 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -12.1440 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -10.9630 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 -13.3860 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -13.2860 -4.3330 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9540 1.8670 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 2.0390 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 2.0760 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -0.2620 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.6760 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -2.2310 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 0.1620 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -6.8700 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -5.3130 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -8.7320 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -8.7530 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -10.8130 -3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -13.0990 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -11.0360 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -14.4640 -3.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 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 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 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 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 2 0 0 0 0 M CHG 1 25 -1 M END