PUBCHEM-ZINC03870975 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 0.0070 1.5760 0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 0.1100 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -0.4890 1.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.5160 -0.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -1.9810 -1.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4920 -2.4140 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -2.5960 -1.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4700 -3.5540 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -2.8920 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -2.5340 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -1.8120 -3.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -2.4170 -2.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5270 -3.5190 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -2.0550 -2.7300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1350 -0.9690 -2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -2.7270 -4.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1830 -3.8020 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -2.5610 -4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -2.1750 -5.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -2.5540 -5.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -2.5200 -1.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -1.9290 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -3.0400 -4.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -3.3750 -5.2360 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8680 2.1440 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 1.8080 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 1.8630 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 0.0500 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -3.5190 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -3.2420 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -1.5250 -4.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -2.8490 -5.8710 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8430 -2.4200 -6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -3.8530 -6.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -2.4400 -6.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -3.0800 -5.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -1.7750 -0.2470 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3160 -2.2820 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -1.4030 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -0.9480 -0.7860 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 37 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 36 2 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 32 1 M CHG 1 37 1 M END