PUBCHEM-ZINC03688069 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -0.5280 1.6980 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 0.2100 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -0.4010 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.7710 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -2.5910 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -3.9780 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -4.5620 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -3.7450 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -2.3520 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -1.4780 0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -2.0190 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -0.8640 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -6.0120 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -6.9110 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -8.2180 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -9.5090 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 -10.6180 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -10.4330 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -9.1620 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -8.0770 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -6.7390 -0.8810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -6.3410 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -11.9960 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -12.7900 0.9680 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -12.6670 0.3430 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -11.9860 2.3230 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 -6.6010 1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -6.4650 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -6.2600 4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -6.1490 5.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 2.2170 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 1.8740 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 2.1360 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.2040 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 0.0630 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.1840 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -4.6000 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -4.2200 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 -2.6890 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -2.5570 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -1.2260 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5870 -0.1670 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -0.2970 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -9.6420 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -11.2900 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -9.0280 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -7.3990 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -5.6810 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -5.6220 3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -7.3630 3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -7.1000 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -5.3520 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -5.2720 5.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -7.0490 6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -5.9910 6.8840 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2360 -5.8880 7.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -5.1530 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -6.8040 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 55 1 M END