PUBCHEM-ZINC03091319 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 0.0050 1.5030 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -0.6910 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.0720 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.7710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -2.0780 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -0.6960 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 0.0560 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -4.2500 2.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -6.1900 1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -6.9940 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -6.7470 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -7.7970 4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -9.1020 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -9.3680 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -8.3180 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -8.2440 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -6.9930 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -7.5320 5.9350 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5980 -6.3900 6.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -8.4570 6.7180 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8000 1.8770 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8590 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 1.8630 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -0.1470 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -2.6080 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.6180 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 0.2480 -2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -0.5390 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 1.0030 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -4.6510 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -5.7350 3.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -9.9150 4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -10.3860 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -9.0810 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END