PUBCHEM-ZINC05480882 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 -0.0600 1.4380 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0450 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -0.6540 -0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -0.6940 0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -2.1110 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -2.2370 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -3.7160 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -3.8370 3.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -5.0560 4.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -6.0530 3.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -5.1800 5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -6.5330 6.2160 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -4.5630 6.1960 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -4.5590 6.5570 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -0.0150 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -0.3480 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 0.3240 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 1.3280 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 1.6610 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 0.9890 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0870 2.0460 0.1730 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9560 1.7540 -0.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 2.9300 0.9880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9160 1.7680 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 1.6530 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.9660 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -2.5910 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -2.5950 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.7570 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -1.7530 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -4.1970 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -4.2000 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -3.0400 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -1.1310 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 0.0660 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 2.4460 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 1.2470 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 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 13 1 0 0 0 0 11 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 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 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END