PUBCHEM-ZINC05818960 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 0 0 0 0 0 0999 V2000 0.0110 1.5090 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0190 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5410 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -0.1010 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.0260 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -2.0460 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -2.7250 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -4.1040 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -4.8080 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -4.1250 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -2.7450 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -4.8860 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -3.9010 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -5.7010 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -5.8290 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -6.6020 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -6.1650 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -6.7850 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -7.0980 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -7.7290 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -8.0550 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -7.7520 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -7.1080 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -6.7750 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -6.2200 2.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -8.7330 -0.5310 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0370 -9.0030 -1.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -9.0210 0.4590 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0340 1.8800 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.9130 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8220 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -0.3320 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.4230 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.9880 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -0.4720 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -0.5040 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -0.2870 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -0.3460 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 1.1150 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -2.1760 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -4.6340 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -2.2120 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 -3.2300 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -4.4520 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -3.3200 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -6.4030 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 -6.2520 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -5.0300 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -6.5300 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -5.2480 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -7.1830 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 -7.2740 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -5.9000 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -6.8470 -2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -7.9710 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -8.0080 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -7.0870 3.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -6.8490 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 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 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 20 55 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 57 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END