PUBCHEM-ZINC05887155 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0990 1.4900 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.0390 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.5130 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.9770 -1.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -2.6460 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.0450 -2.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -4.1080 -1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -4.7410 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -6.0820 -1.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -6.7880 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -6.2480 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -5.0730 -2.2780 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3130 -4.8820 -3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -6.1560 -3.8100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9200 -6.2600 -4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -7.3730 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -7.4490 -2.3890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -8.6630 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -8.8940 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -10.0940 -3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -11.0670 -2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -10.8410 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -9.6400 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -11.9050 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -12.3760 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -6.0710 -4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -3.9780 -0.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -2.6360 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -1.9960 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -4.6370 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 1.8690 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.8640 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.8280 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -0.4130 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -0.4180 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -0.1390 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -0.1340 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -4.6760 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -4.0440 -3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 -7.2580 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -8.2800 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -8.1340 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -10.2740 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -9.4620 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -11.7660 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -11.8290 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -12.8880 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -12.2970 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -13.1670 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -12.6120 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 -5.2060 -5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -6.9780 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -5.9670 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -4.7750 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 -4.0190 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -5.6080 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 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 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 27 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 11 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 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 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M CHG 1 12 1 M END