PUBCHEM-ZINC06126561 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -2.5650 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -3.8760 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -4.6930 0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -4.3280 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -5.7860 2.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -6.4070 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -6.5730 3.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3470 -7.1970 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -7.2180 2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -6.1870 3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -5.3600 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -5.2860 3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -6.5580 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -6.0450 3.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -8.0580 3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -8.6910 3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -10.1910 3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -10.7040 3.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -10.9630 4.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -12.3470 4.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -13.1770 4.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -14.4630 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -14.7310 4.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -13.2010 3.7000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -2.5820 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.4290 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -1.9120 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.8720 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.0250 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -7.3840 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -5.7720 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -8.1630 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -7.3690 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -6.6850 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 -5.5580 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -5.8750 5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 -4.3640 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -8.4060 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -8.3460 3.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -8.3430 4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -8.4040 3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -10.5520 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -15.2350 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -15.7140 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 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 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 M END