PUBCHEM-ZINC03869174 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.4530 1.6280 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.2290 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -0.5710 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 0.0820 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 1.4770 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 2.2560 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 3.7360 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 4.4050 0.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 4.2450 -0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 5.6640 -0.4350 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9530 6.2850 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 6.0160 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 5.8750 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 5.5550 2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 4.3770 2.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 5.9170 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 4.8710 -2.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -1.9980 0.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -2.7440 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -2.9090 1.1440 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2370 -3.8320 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -3.0190 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -1.7000 0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -0.5570 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -0.6580 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 0.5270 2.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 0.4770 3.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 1.6420 2.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5360 2.5270 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 1.6510 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 0.6070 0.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 2.8540 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -1.7940 2.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -2.7240 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -3.9280 1.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 2.2210 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -0.1990 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -0.4610 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 1.9250 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 3.6490 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8040 5.3960 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 7.0520 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 6.7940 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 5.0590 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -3.7500 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -2.3090 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -3.5030 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -3.6420 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 -1.5470 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 3.6380 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8840 3.0280 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -1.7890 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -2.1220 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 6.4790 3.7370 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4990 7.1040 -2.2440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 54 1 0 0 0 0 16 17 2 0 0 0 0 16 55 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 34 35 2 0 0 0 0 34 53 1 0 0 0 0 M CHG 1 54 -1 M CHG 1 55 -1 M END