PUBCHEM-ZINC05125411 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.8070 -0.7020 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.2380 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.7520 -0.2170 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8160 0.9810 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 0.4810 -0.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1540 -0.1230 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -0.3220 -1.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 1.6450 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 2.1410 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 3.2080 -2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 3.7800 -3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 3.2840 -3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 2.2200 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 4.9220 -4.4930 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2010 5.3580 -4.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 5.4250 -5.0690 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.2580 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -2.8940 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -4.2750 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -5.0200 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -4.3840 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -3.0030 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -0.2510 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -0.3980 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -1.7880 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.8520 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.6300 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 1.8510 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 1.2000 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 1.6940 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 3.5950 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 3.7300 -3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 1.8350 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.3120 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -4.7720 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -6.0980 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -4.9660 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -2.5060 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -0.2000 0.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -0.8750 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 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 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END