PUBCHEM-ZINC04904972 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.2020 1.4290 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.0940 -0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0680 -0.5440 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -0.5880 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -2.0740 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -2.8480 1.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -2.5560 -0.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5320 -2.2420 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -1.9370 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.1700 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 0.0320 -3.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9970 -1.0240 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 0.6970 -4.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 2.0560 -5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 2.6660 -6.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 1.9170 -6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 0.5590 -6.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -0.0520 -5.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -0.2420 -7.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5260 0.2960 -8.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -1.4400 -7.5510 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0990 0.6570 -3.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -4.0820 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 1.8820 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 1.7680 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.7220 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -0.0630 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -0.4080 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -2.1820 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -2.3350 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 1.2260 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3070 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 2.6400 -4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 3.7270 -6.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 2.3940 -7.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -1.1140 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 1.6000 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -4.3910 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 -4.4250 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -4.5170 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -0.4790 -1.2600 N 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END