PUBCHEM-ZINC05547277 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -1.4750 1.1290 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.3750 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -1.0920 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -2.4860 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -3.2040 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -2.4840 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -1.0810 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.3440 -2.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -0.8360 -4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -1.9580 -4.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 0.2150 -5.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.4280 -6.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.4080 -6.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -1.0320 -6.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -1.6880 -8.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -1.7200 -8.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -1.0970 -7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 1.1620 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 2.4660 -6.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 3.3610 -6.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 2.9640 -6.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 1.6720 -6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 0.7750 -5.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -4.7170 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -5.3020 -1.4880 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4890 1.5410 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 1.5210 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 1.4890 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.5690 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -3.0200 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -3.0590 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 0.6550 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 0.8480 -4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 0.0800 -5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -1.0150 -6.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -2.1840 -8.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -2.2400 -9.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -1.1620 -7.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 2.7930 -5.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 4.3660 -6.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 3.6600 -7.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 1.3580 -6.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -0.2310 -5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -5.2920 0.6990 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 24 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 2 0 0 0 0 M CHG 1 25 -1 M END