PUBCHEM-ZINC06710697 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.6840 1.9030 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 0.6730 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -0.7520 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -1.5010 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -1.8220 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -1.9200 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -1.8460 3.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -2.2370 4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -2.3610 4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -2.8060 6.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -3.1400 7.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -2.9450 6.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -2.5110 5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -3.2420 7.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -3.1220 9.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -3.6770 8.4430 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5490 -2.8980 8.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -4.9570 8.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1930 -4.9490 8.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -6.1700 8.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -7.3530 8.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -7.2710 8.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 -6.1060 8.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 1.8130 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 2.7910 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 2.0750 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 0.7310 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 0.5560 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -1.2760 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 0.2390 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.9650 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -1.5990 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -2.5090 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -1.7810 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -2.6850 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -2.8780 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -1.0970 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -2.1220 4.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -2.8960 6.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -2.3930 5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.5440 7.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -4.2550 7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -2.1020 9.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -3.4590 9.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -4.0260 8.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 -6.2010 8.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6220 -8.3150 8.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -8.1690 8.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -0.5700 0.9420 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2630 -0.4540 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -3.9950 9.3580 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1410 -4.0230 10.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -4.9840 9.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 49 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 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 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 51 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 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 M CHG 1 49 1 M CHG 1 51 1 M END