PUBCHEM-ZINC03091285 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.2290 1.4810 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.0140 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.8660 1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.1130 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -1.9900 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.6690 -1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -3.0860 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -4.0860 -1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -5.1080 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -5.1430 -3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -4.1550 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -3.1250 -2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -6.2420 -4.5660 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5710 -7.1130 -4.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -6.2760 -5.5660 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0290 -3.3750 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.4930 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -5.6660 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -5.7320 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -4.6260 3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -3.4470 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -6.9930 3.5900 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5050 -7.9690 3.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -7.0550 4.6310 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2800 1.7680 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 1.9690 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 1.7880 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -4.0610 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1040 -5.8820 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -4.1890 -4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.3530 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -4.4420 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -6.5320 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -4.6850 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -2.5830 2.9220 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 22 1 M CHG 1 24 -1 M END