PUBCHEM-ZINC03946372 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 78 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3730 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 0.0380 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.4280 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.4470 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 -0.8660 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -0.6260 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -2.1600 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -2.1080 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -3.2910 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -4.5360 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -4.5860 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -3.3990 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -3.7320 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -5.1060 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -5.6930 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -7.0820 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -7.8760 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 -7.2980 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -5.9210 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -8.0900 -0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -2.7660 -0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7010 -1.7780 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 -2.7180 1.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0750 -3.7140 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 -1.7520 1.2870 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5630 -0.7460 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9010 -2.2050 0.2040 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2920 -3.1900 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1730 -2.2720 -1.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8180 -1.2780 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0620 -3.1640 -1.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1350 -2.7810 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4920 -2.7340 -3.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9790 -1.2700 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5670 -1.7550 2.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -2.2660 2.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -5.5540 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -6.7570 -0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -4.9280 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -3.5930 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -2.7720 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -5.5650 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -5.5040 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 -5.5080 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -6.7560 0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -6.7170 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -7.9090 1.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.8980 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 1.9910 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.8360 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -7.5320 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 -8.9510 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 -5.4800 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -8.3160 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -2.1520 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 -3.8080 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0440 -3.0430 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4820 -1.1740 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3310 -1.1640 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 -2.2120 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -5.1830 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 -4.5900 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 -5.3730 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -4.6960 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -6.8300 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -6.7630 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -6.6260 3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -8.7190 2.0140 H 0 0 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 51 1 0 0 0 0 2 3 2 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 53 1 0 0 0 0 6 7 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 24 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 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 39 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 38 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 37 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 36 61 1 0 0 0 0 37 62 1 0 0 0 0 38 63 1 0 0 0 0 39 64 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 45 1 0 0 0 0 43 44 2 0 0 0 0 45 46 1 0 0 0 0 45 65 1 0 0 0 0 46 47 1 0 0 0 0 46 49 1 0 0 0 0 46 66 1 0 0 0 0 47 48 1 0 0 0 0 47 67 1 0 0 0 0 47 68 1 0 0 0 0 48 69 1 0 0 0 0 49 50 1 0 0 0 0 49 70 1 0 0 0 0 49 71 1 0 0 0 0 50 72 1 0 0 0 0 M END