PUBCHEM-ZINC02980754 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.4030 0.7200 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.4660 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -0.9040 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.1670 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 1.0340 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 1.4700 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.6440 -0.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7440 -1.6920 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.5890 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -1.6100 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -2.7190 2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -3.6950 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -3.5970 4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -2.5190 4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -1.5290 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 -0.4580 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 0.5550 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 0.4770 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 1.5010 0.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 1.7210 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8750 2.5640 2.2560 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4490 0.0840 -1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -0.2790 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -1.2380 -2.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 0.5770 -3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 0.6580 -4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 1.4650 -5.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 2.1540 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 2.0860 -3.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 1.2950 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 1.0660 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -1.0440 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -1.8190 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 1.6480 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 2.4010 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -2.8480 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -4.5300 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -4.3530 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 -2.4570 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -0.3970 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 2.1500 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 0.9070 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 0.1040 -5.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 1.5510 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 2.7960 -5.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 1.2550 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 1.7770 4.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 47 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 30 46 1 0 0 0 0 M CHG 1 21 -1 M END