IBS-ZINC05209244 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.0080 1.2980 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0120 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -0.7470 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -1.6790 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.9400 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -3.3120 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -3.8550 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -3.3690 3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -2.0760 3.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -1.7340 4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -1.2690 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -0.1260 2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -4.1640 4.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -5.2380 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -6.0120 2.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -5.6880 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -6.9260 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -7.3780 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -6.5270 -1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -6.9580 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -8.2300 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -9.0780 -1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -8.6640 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -9.5910 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -10.8090 0.2190 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -9.8140 0.8700 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 -9.0120 1.6290 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 1.8510 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 1.8250 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.5650 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -1.3020 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -0.0310 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -3.7760 5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -5.0280 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -7.5860 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -5.5340 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -6.3010 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -8.5610 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -10.0680 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M END