PUBCHEM-ZINC05962501 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.9310 0.3520 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 0.3560 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 1.7950 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -0.4080 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 0.2840 -2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -0.4370 -3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 -1.6920 -2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -2.5350 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -1.9020 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.6670 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -4.0640 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -4.6860 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -3.9280 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -4.9080 -0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -4.5220 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -3.3860 0.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -5.6430 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -6.7350 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 -7.7790 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -7.7410 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -8.7930 2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -8.7530 3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 -7.6350 4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -6.5810 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0760 -6.6210 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -5.5750 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -9.8730 4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 -9.6360 4.9040 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9460 -8.6900 4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1580 -10.3770 5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.6690 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 0.8300 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 0.8870 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -0.1300 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 2.3920 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 1.8130 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 2.2870 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -0.6800 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 0.2280 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -2.2420 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -1.4290 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -2.1810 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -5.7680 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -4.4290 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -5.9020 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -6.7800 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -8.6240 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 -9.6490 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -7.5800 5.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 -5.7270 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -4.7050 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -11.0970 4.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -11.2470 3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -11.9030 4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 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 26 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 28 1 M END