PUBCHEM-ZINC06907108 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.6930 -0.2560 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.3110 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -1.4520 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -0.4660 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -0.3890 2.7750 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3010 -1.0840 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -0.7960 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 0.1920 3.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.9710 3.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 1.5000 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 0.8630 3.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 2.9660 3.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4430 2.9790 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 3.8920 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 3.3780 4.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 3.2980 5.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 2.9390 6.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 3.6780 6.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4320 3.6240 7.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 3.9930 7.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 4.4140 6.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2820 4.4650 5.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 4.0940 5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 4.1300 3.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 4.4280 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 3.7710 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 3.8240 2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -1.1780 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.1170 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.5810 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 0.6370 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -2.4240 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -1.4700 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -1.3410 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.4220 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 0.3140 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 1.4960 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 3.7050 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 4.9440 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 3.7300 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 3.2960 8.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 3.9510 8.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 4.7000 7.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0130 4.7920 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -2.0300 3.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 45 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 45 -1 M END