PUBCHEM-ZINC06036496 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.0140 1.3330 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.1660 -0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0720 -0.5010 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -0.4980 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -1.9260 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -2.1830 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -2.0020 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -2.2270 5.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -2.6310 5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -2.8070 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -2.5830 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -1.1330 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -1.4710 -3.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6950 -2.4820 -3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -1.3500 -4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -2.5100 -5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -2.4020 -6.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -3.3420 -7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -2.6420 -8.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -1.3140 -8.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 -0.5470 -8.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -1.1390 -7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 0.0450 -6.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -0.0930 -5.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 1.3640 -7.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 1.4920 -7.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 2.4030 -6.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -0.5810 -3.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.6800 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 1.5920 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 1.8980 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -0.3360 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 0.2050 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.0950 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.6680 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -1.6850 4.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -2.0890 6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -2.8070 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -3.1200 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -2.7250 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -0.2040 -2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -1.9380 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -3.4930 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -4.4170 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -2.9730 -9.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 0.7930 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 2.3450 -6.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 3.3010 -7.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -0.6600 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.9000 -1.2880 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2460 -0.3790 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -1.8030 -1.0330 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 2 4 1 0 0 0 0 2 50 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END