PUBCHEM-ZINC05504454 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.9770 1.6410 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 0.1690 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -0.6860 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -2.0550 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.5890 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -1.7300 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -0.3620 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -4.0730 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -4.8730 -0.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0420 -4.5600 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -4.7020 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -4.7920 -1.8690 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.1280 -4.6400 -3.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -4.6400 -2.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -6.3760 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -6.8250 0.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -7.1240 -0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -8.4980 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -9.3470 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -10.6990 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -11.2140 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -10.3790 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -9.0240 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 -10.9350 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -11.9720 0.4410 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 -10.0140 -0.2400 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 -11.4100 -1.6450 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 2.1440 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 2.0750 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 1.8400 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -0.2920 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -2.7020 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.1220 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 0.2840 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -4.2470 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -4.4230 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -6.6200 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -8.9890 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -11.3500 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -12.2700 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -8.3760 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -4.7390 -3.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 42 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M CHG 1 12 -1 M END