PUBCHEM-ZINC04998293 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.5840 1.1410 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.0230 0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -0.6230 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -1.7580 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -2.3680 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -1.8450 -3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.7090 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.1040 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.4630 -4.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -1.7190 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -0.5060 -5.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -2.3770 -6.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -3.7690 -6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -4.3780 -7.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -3.6170 -8.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -2.2420 -8.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -1.6090 -7.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -0.2240 -7.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 0.5650 -8.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 2.0290 -8.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 2.6360 -7.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 3.9850 -7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 4.6760 -7.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 4.0660 -8.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 2.7850 -8.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -5.8520 -7.8830 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4390 -6.5240 -6.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -6.3940 -8.8840 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0380 1.9070 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 0.8850 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 1.5200 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -2.1640 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -3.2510 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -0.3020 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.7780 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -3.4250 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -4.3670 -5.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -4.1040 -9.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -1.6560 -9.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 0.2200 -6.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 0.2730 -8.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 0.3850 -9.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 2.0710 -6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 4.4900 -6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 5.7270 -7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 2.3210 -9.2230 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END