PUBCHEM-ZINC04682114 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.3770 0.5880 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.4900 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 2.4700 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 2.5370 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 1.6330 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 0.6600 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 1.7360 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 2.6180 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 3.0400 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 1.8730 -3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 1.2670 -3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 0.8610 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 2.3290 -5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 3.5030 -5.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 1.2970 -6.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 1.5510 -7.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9780 0.3590 -8.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 -0.5940 -8.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -1.6950 -9.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1670 -1.8130 -9.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9640 -0.9230 -8.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3530 0.1400 -8.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 3.4830 -1.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.1710 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 1.4290 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 3.1620 -0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -0.0500 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 2.5550 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 0.8140 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 1.8530 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 3.4850 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 3.8670 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 3.4340 -2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 1.1070 -3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 1.9890 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 0.3900 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 0.5260 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 0.0620 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 0.3410 -5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 1.8240 -7.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 2.4230 -7.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -0.4810 -8.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -2.4410 -9.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 -2.6530 -9.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 0.8340 -7.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 4.1080 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 2.0400 -1.2050 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4640 2.7790 -1.4760 H 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 47 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END