PUBCHEM-ZINC05125497 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 -0.8240 1.4270 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -0.0500 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.5850 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -1.9460 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -2.7640 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -2.2230 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -0.8680 -1.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -0.2810 -2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -4.2150 0.1700 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2980 -4.9140 -0.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -4.7100 1.2820 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0350 -2.4900 2.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.6100 3.5810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4230 -0.6130 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -2.1690 4.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1290 -2.1840 4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -1.2770 5.8140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5120 -0.2770 5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -1.2020 6.4170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2200 -0.5250 7.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6800 5.3570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9110 0.3290 5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -1.5380 4.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -0.6590 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -0.0640 4.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -2.5040 6.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -1.8310 6.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -3.4980 4.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 1.9490 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.5950 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 1.8040 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 0.0540 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -2.8580 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 0.0260 -3.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -1.0300 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 0.5840 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -3.4510 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -1.6790 6.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -0.0770 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 -0.0170 5.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.8970 7.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -1.9130 6.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -4.1160 4.2020 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END