PUBCHEM-ZINC05889286 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 0.2220 1.3370 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.0730 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -0.5850 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -1.9720 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -2.6230 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -1.9010 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -0.5070 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 0.1450 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9540 -2.6280 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 -2.0410 0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 -1.0550 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1560 -3.0190 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5520 -2.9780 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2500 -4.1990 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5290 -5.3990 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1250 -5.4110 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.1950 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -3.9400 0.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7190 -4.1640 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5430 -5.2520 0.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2420 -6.1920 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8490 -4.8470 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0640 -5.5310 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2430 -4.7810 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1670 -3.4030 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9340 -2.7440 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7600 -3.4890 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4520 -3.0870 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.5560 -5.4370 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4660 -4.9370 1.0190 N 0 3 0 0 0 0 0 0 0 0 0 0 -17.2530 -4.1220 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.3820 -5.3530 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 1.5810 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.6840 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 1.8550 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -2.5550 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -3.7060 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 0.1090 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 1.2260 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0830 -2.0360 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -6.3590 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 -6.3410 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0870 -6.5930 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0740 -2.8190 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8790 -1.6820 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7980 -6.5130 -0.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.0950 -6.8660 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6850 -6.9970 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 30 1 M END