PUBCHEM-ZINC06816896 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.0360 1.5500 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 0.1010 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -0.6700 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -2.0330 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -2.7790 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -4.0050 -0.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -1.9150 -1.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -0.4910 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 0.1670 -2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -2.5260 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -2.4610 2.2910 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7250 -1.3700 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.2870 2.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 0.6680 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -3.8730 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -4.1410 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -3.2060 4.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -5.4760 4.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -5.7600 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -6.8780 5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -7.7850 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -6.6520 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -9.2810 6.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 1.8470 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 2.0430 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.8770 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -2.1950 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -2.1830 -3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -3.6180 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -1.3480 4.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -4.1460 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -4.4920 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -6.0500 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -4.8590 5.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -7.1620 6.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -6.5840 6.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -7.4950 5.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -8.6970 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -6.3730 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -7.0070 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -9.0230 6.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -9.4880 6.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -10.1400 5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -8.1090 5.2020 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1660 -8.3850 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 44 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 11 1 M CHG 1 44 1 M END