PUBCHEM-ZINC02571696 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.3700 1.5190 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.0060 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -0.4930 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -2.0060 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -2.4980 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -2.5460 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -2.9970 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -3.4010 -4.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -3.3520 -4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.9050 -3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.8580 -5.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 -4.5320 -5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -4.8270 -4.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -4.9120 -7.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 -5.6100 -6.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2010 -5.9620 -8.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -5.6240 -9.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 -4.9310 -9.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -4.5790 -8.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4550 -6.0040 -10.5410 N 0 3 0 0 0 0 0 0 0 0 0 0 8.5050 -6.6130 -10.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0210 -5.7070 -11.6400 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5980 2.0120 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.7490 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 1.8750 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.2240 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.4860 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.2630 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 0.0000 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -2.2360 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -2.4990 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -2.2310 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -3.0340 -3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -3.6650 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.8700 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -3.6890 -6.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -5.8740 -5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 -6.5020 -7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 -4.6700 -10.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -4.0430 -8.3930 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 4 1 0 0 0 0 3 28 1 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 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END