PUBCHEM-ZINC06070687 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.0410 1.6530 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.1570 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.4960 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.8960 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.6970 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.0210 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.6140 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -2.9160 -2.9190 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -3.7080 -2.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -3.6520 -2.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -4.4940 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -5.0360 1.9930 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -5.0830 2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -4.7130 1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -4.7280 2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -5.1060 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -5.4960 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -5.4820 3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -6.0050 5.0810 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -7.1300 4.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -4.7940 5.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8480 -5.1540 3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 2.0140 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 2.0060 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 2.0960 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 0.0760 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.3310 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.1160 -2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -4.4010 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 -4.4380 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -5.8120 5.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -6.1480 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 -4.9300 4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -4.4120 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -1.8530 -3.9180 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5770 -6.3740 6.2600 O 0 5 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END