PUBCHEM-ZINC06440447 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 1.0180 1.8140 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 0.3390 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.4940 1.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7510 -0.0990 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -0.4250 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 -1.9260 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.6410 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -3.9560 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -4.5590 2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -3.8480 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -2.5270 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -1.8250 3.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -2.5070 4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -1.5770 4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -0.4410 4.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -2.0070 5.7930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9150 -1.1430 6.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -1.5920 7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 -2.9800 7.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6310 -3.5800 8.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -4.9580 8.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 -5.1460 7.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -3.9560 6.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9600 -6.5200 6.8880 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3220 -7.5430 7.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -6.5740 5.9680 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9180 2.4070 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 1.9340 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 2.1520 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 0.0010 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 0.2190 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -0.8200 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -1.0180 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 0.6110 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -2.1720 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -4.5130 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -5.5860 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -4.3200 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -3.3760 3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -2.8320 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -2.9160 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4310 -0.9040 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2860 -3.0820 9.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 -5.7270 8.9820 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END