PUBCHEM-ZINC01350504 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.5240 1.4590 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 0.0310 -1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.6200 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.1020 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -0.5590 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -1.9390 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -2.6660 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -2.0040 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -4.0640 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -4.6890 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -4.0410 0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -6.0330 0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -6.9370 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 -8.2130 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -8.3160 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -6.8380 0.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5450 -6.5480 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -6.6440 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 -6.0920 -0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5920 -5.7590 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5850 -6.0910 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7600 -5.6670 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9170 -5.8120 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9090 -6.3800 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -6.8030 -4.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5660 -6.6650 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 -6.9760 -2.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 1.8510 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 1.8380 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 1.7760 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 1.1810 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 0.0050 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -2.4530 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.5670 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -4.5830 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -7.1740 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -6.4860 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -9.0840 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -8.0830 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -8.8010 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 -8.8480 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 -5.2250 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8300 -5.4830 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 -6.4880 -5.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -7.2440 -4.9190 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 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 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 27 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 M END