PUBCHEM-ZINC06078015 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.7900 2.0400 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 0.5580 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -0.1600 -1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.5750 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -2.2610 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -1.8670 -2.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -2.5250 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 -1.8200 -2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -0.6870 -2.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 0.0290 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -0.7110 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 0.2970 -3.8180 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3440 1.6720 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 2.3970 -5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 0.8710 -5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 0.0840 -4.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 3.1370 -6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -2.1860 -1.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -3.3770 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4510 -3.7870 -0.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -4.1110 -0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -4.9760 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -3.7900 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -4.5010 -0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4140 -1.3390 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 2.2910 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 2.3230 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 2.6350 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 0.2820 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.3160 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -1.8650 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.8560 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -3.3480 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.9900 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 2.2320 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 1.6550 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 3.4560 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 1.9380 -5.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 0.4550 -6.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 0.8590 -6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -0.9720 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 0.3680 -3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 2.7410 -7.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 4.1730 -6.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 3.0700 -7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 -0.3540 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3150 -1.7580 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 -1.2340 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 2.3130 -5.5990 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1140 2.7160 -4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 49 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 12 1 M CHG 1 49 1 M END