PUBCHEM-ZINC03696145 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.8230 1.4980 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 0.1870 0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -0.3490 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.5250 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -0.0280 -2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -0.7360 -3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -1.9840 -3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -2.5050 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -1.7850 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.7510 -4.8260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0360 -2.1000 -5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -3.2250 -5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -2.3510 -5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -2.7640 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -4.0580 -5.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -4.9260 -6.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -4.5190 -5.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -5.5000 -5.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -4.8070 -5.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4970 -4.5940 -6.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -3.7860 -6.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 -4.6100 -6.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1050 -5.8380 -5.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2380 -6.5960 -6.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1560 -6.1340 -7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9420 -4.9120 -7.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8100 -4.1520 -7.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 1.4320 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 2.2100 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.9220 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.3310 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.5050 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.2960 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 0.9390 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -0.2830 -4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -3.4690 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -2.2440 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -1.3300 -4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -2.0480 -5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -5.9330 -6.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -6.1810 -5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -6.1030 -6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -5.5260 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -4.2180 -6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7550 -3.4600 -5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6010 -2.9090 -6.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 -6.2110 -5.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 -7.5480 -5.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0370 -6.7240 -7.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6590 -4.5510 -8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6670 -3.2010 -7.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -3.8700 -4.8190 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6730 -3.4600 -4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -4.3870 -3.9360 H 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 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END