PUBCHEM-ZINC04536218 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 1 0 0 0 0 0999 V2000 0.8010 0.8460 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -0.4070 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -1.0250 -0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -0.3680 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.9340 1.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 0.9440 0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 1.5280 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 2.8290 -1.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -2.3930 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9060 -2.5760 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -3.5280 -0.8220 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7950 -4.2050 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -4.2690 -1.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2460 -5.3510 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -3.9460 -0.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8740 -4.5310 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -2.5650 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -4.1100 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 -3.8620 0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 -2.9890 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -3.7860 -2.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -4.5350 -3.9430 P 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -4.4560 -3.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -3.4940 -5.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -3.6380 -6.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -3.6080 -7.5610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9260 -4.1140 -7.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -4.1880 -8.8140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6670 -5.2820 -8.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -3.5720 -9.9130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0910 -4.1640 -10.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -2.2000 -9.3370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6400 -2.0340 -9.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -2.2430 -7.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.0580 -9.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -0.5590 -9.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 0.4800 -10.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 0.6590 -11.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -0.2660 -10.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -0.3960 -11.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 2.1260 -13.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 0.4880 -12.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 1.4720 -12.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 1.6370 -12.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.5210 -12.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 0.4810 -13.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.5440 -11.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -3.4390 -10.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -3.7370 -9.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -4.2710 -8.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -3.0950 -1.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -3.7120 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 1.3610 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -0.9880 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 3.3620 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 3.2780 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -3.3940 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -5.1250 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -2.8170 -6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -4.5890 -6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -0.9940 -8.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -0.2180 -12.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 1.1330 -13.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -5.8540 -4.2020 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 55 1 0 0 0 0 8 56 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 51 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 64 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 34 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 47 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 61 1 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 44 1 0 0 0 0 39 40 1 0 0 0 0 40 42 2 0 0 0 0 41 43 1 0 0 0 0 42 43 1 0 0 0 0 42 46 1 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 46 62 1 0 0 0 0 46 63 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 64 -1 M END