PUBCHEM-ZINC05759527 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 62 0 0 1 0 0 0 0 0999 V2000 -0.2330 2.1330 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.6180 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 0.1560 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.0960 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -1.6200 -0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7710 -2.0880 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 -2.2290 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -2.5410 -1.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -2.3740 0.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -2.2170 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -3.0670 3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -2.8660 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -2.7400 0.8000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9350 -3.7000 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -1.6940 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -0.4770 0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -1.9640 -1.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -1.3490 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -3.1000 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -3.8830 -0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -3.3680 -2.8390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2510 -2.8130 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -4.8900 -3.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2850 -5.2710 -2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -5.2570 -4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -6.7260 -4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -7.0060 -6.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -8.4520 -6.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -2.9900 -2.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 2.6610 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 2.4890 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 2.4140 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 0.4090 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 0.2750 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -0.8940 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 0.7390 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 0.1420 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 0.3260 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -2.5410 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -1.1590 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -4.1230 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -2.7760 4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -3.7030 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -1.9600 2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -4.6270 -5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -5.0300 -4.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -7.3830 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -6.9680 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -6.3320 -6.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -6.7910 -6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -9.1580 -6.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -8.6860 -6.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -2.0240 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -2.1880 -0.4630 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2210 -8.6810 -8.1520 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0280 -9.6560 -8.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -8.5090 -8.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -8.0850 -8.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -5.5530 -2.1150 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6890 -6.5760 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -5.2680 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -5.1530 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 54 1 0 0 0 0 17 18 1 0 0 0 0 17 19 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 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 59 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 55 1 0 0 0 0 29 53 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 59 62 1 0 0 0 0 M CHG 1 54 -1 M CHG 1 55 1 M CHG 1 59 1 M END