PUBCHEM-ZINC02041573 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0330 1.5670 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 0.0390 0.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5090 -0.3600 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.4770 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -1.1330 0.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.2070 -0.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -0.7940 -0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -2.0060 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -2.6000 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 -1.9880 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 -0.7790 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -0.1840 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 1.1060 0.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2480 1.6410 0.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 1.6330 0.3780 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6620 -0.3870 1.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -0.5030 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.2530 0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -0.8940 2.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -0.9970 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -1.4450 3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 -2.7930 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 -3.2040 5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 -2.2670 6.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 -0.9190 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -0.5080 4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 1.9400 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8840 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 1.9660 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8570 -2.4850 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -3.5440 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9480 -2.4540 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6010 -0.3020 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -0.5860 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -1.7220 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -0.0240 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -3.5250 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 -4.2570 5.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -2.5880 7.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 -0.1870 6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 0.5450 4.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 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 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END