PUBCHEM-ZINC05720844 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -2.5410 -1.6100 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -1.5260 -0.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5490 -2.3680 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -1.5540 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -1.2990 1.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -0.1530 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.1890 -0.7770 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3370 -1.0500 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -0.3050 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 1.0830 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -1.9430 2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -3.3480 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -4.2890 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -5.6610 1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -6.1200 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -5.2020 3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -3.8310 3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -3.0280 4.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -1.7110 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -1.1400 3.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -0.8150 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 -1.1020 5.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 -0.3150 7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -0.2020 5.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -0.7530 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -1.5840 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -2.5300 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.7530 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -2.4940 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 0.7630 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -0.1450 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.2200 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.0470 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 1.9630 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -3.9580 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -6.3640 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -7.1870 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -5.5730 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 0.2350 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -1.0010 6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 -2.1150 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -0.9750 4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 -1.3410 7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -0.1030 7.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 0.4020 8.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 0.0220 4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5290 -1.2060 5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 0.5540 6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 -0.1330 6.0430 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3910 0.8210 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 49 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 49 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END