PUBCHEM-ZINC00336339 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 0.2170 1.4070 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 0.0390 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.5180 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 0.2120 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 -0.4420 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -1.8470 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -2.5950 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -1.9200 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -2.6490 0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -2.8760 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -3.9660 0.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -4.6610 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 0.3580 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 0.6530 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 1.3750 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3210 1.9070 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4730 2.6300 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8150 2.8360 -2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0060 2.3190 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8400 1.5870 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 1.0410 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 0.3850 -3.6330 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2790 1.6540 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 1.5910 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 2.0550 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 1.2980 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -2.3310 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -1.9340 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -3.4610 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.4530 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -4.3330 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -5.7240 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -4.5550 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 -0.2070 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 1.2850 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 0.3300 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0860 1.7660 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1010 3.0310 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7090 3.3970 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2810 2.4840 -4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 1.2750 -5.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 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 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 2 0 0 0 0 M CHG 1 22 -1 M END