PUBCHEM-ZINC03738970 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -4.8280 0.0670 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -1.0620 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -2.0830 1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -2.7560 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -2.8610 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -3.6210 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -4.2220 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -4.1070 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -3.3910 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -3.2940 -1.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -3.9140 -2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -2.2280 2.3700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -1.3330 2.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.7940 2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.0240 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -1.4190 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -1.3260 4.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -0.6270 3.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -0.0240 2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -0.1020 1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -0.8060 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -1.0320 1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.6840 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -0.5090 4.9000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -2.7860 4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -2.8010 4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 0.8680 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -0.2990 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 0.4810 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4870 -1.4690 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -0.6680 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -3.7610 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -4.7990 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -4.6100 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -3.4850 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -5.0000 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -3.7170 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -1.7910 5.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 0.5160 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 0.3680 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -3.8140 4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -2.3440 5.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -3.5370 5.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -1.8170 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -3.1820 3.4660 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.2510 3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -4.1150 3.2310 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 45 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END