PUBCHEM-ZINC00505698 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0100 1.5170 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0120 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.4960 -1.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7170 -0.0480 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -0.0840 -2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -1.9970 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -2.5840 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -3.9600 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -4.7520 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -4.1610 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -2.7840 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -6.1060 -1.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -6.8590 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -8.3300 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -8.6980 -0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -9.2380 -0.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -10.6060 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -11.0940 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -12.4430 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -13.3090 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -12.8280 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -11.4780 -1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -11.0090 -2.1250 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -12.9630 0.1560 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0900 -12.2010 0.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -14.1530 0.0980 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0130 1.8940 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.8860 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8620 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.3810 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.3890 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 1.0020 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -0.4280 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -0.5320 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -1.9660 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -4.4180 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -4.7760 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.3240 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -6.5890 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -6.6390 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -8.9440 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -10.4180 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -14.3630 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -13.5060 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 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 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END