PUBCHEM-ZINC06133055 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 67 0 0 0 0 0 0 0 0999 V2000 -2.3220 0.9510 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -0.4730 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.4160 -1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -1.6030 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -1.4740 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.6020 -1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -3.8700 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -4.0160 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.8780 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -5.2950 -1.7610 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -6.4770 -1.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -5.1410 -3.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -5.1220 -0.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -5.4450 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -6.9180 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -8.5180 3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -8.7330 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -8.7080 5.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -7.4440 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -7.2120 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 -9.3150 6.7860 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -9.2520 7.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -10.5580 6.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -8.1050 7.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 -7.0010 8.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -6.0560 9.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -6.2140 9.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 -7.3420 8.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 -8.2940 8.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 -5.2030 9.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -5.3150 10.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 -4.0960 11.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 1.4860 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 1.5040 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 0.9630 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.9960 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.9790 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -0.4830 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 -2.4800 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -5.0000 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -3.0200 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 -4.9260 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 -4.7810 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -5.2230 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -7.6090 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -7.1640 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -8.4600 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 -9.3130 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -9.7020 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -7.9500 5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -7.5020 5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -6.5950 5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -8.0100 2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -6.2440 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -6.8610 8.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -5.1870 9.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 -7.5120 8.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -9.1710 7.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7170 -6.2170 10.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 -5.3400 9.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 -3.1770 10.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3400 -4.0360 12.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 -4.1330 11.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 -7.1960 2.7240 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5530 -6.4480 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 15 64 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 64 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 64 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END