PUBCHEM-ZINC00258263 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5720 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.4270 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -3.8150 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -4.3530 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -3.5190 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 -2.1360 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -1.5910 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -4.0680 0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8650 -3.1910 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 -4.0290 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6810 -4.4200 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8300 -5.1890 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4160 -5.5660 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8530 -5.1740 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7070 -4.4020 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6460 -6.3900 0.0870 N 0 3 0 0 0 0 0 0 0 0 0 0 -13.1420 -6.7350 1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1620 -6.7220 -0.9650 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -4.4630 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -5.4260 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -1.4910 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -0.5190 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 -5.0310 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8410 -2.5670 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8570 -2.5570 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2240 -4.1250 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2700 -5.4950 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3110 -5.4690 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2690 -4.0930 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END