PUBCHEM-ZINC03677284 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0390 1.3610 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.0270 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -0.6770 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0550 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 1.4500 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 2.0990 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -0.6510 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -0.9420 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -1.6460 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -2.0820 -0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3390 -2.8090 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7410 -3.1020 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 -2.6690 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -1.9280 -2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -1.4540 -4.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6520 -0.4230 -3.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -2.3770 -4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -3.1320 -5.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -2.8140 -7.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -0.4030 -6.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -0.7810 -5.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 -1.4100 -5.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9660 -3.8730 -2.1920 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7030 -4.0840 -1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -4.2750 -3.3440 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9900 1.8680 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -0.6010 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -1.7600 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 2.0420 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 3.1810 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -0.0070 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.5720 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 -1.8730 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9180 -3.1370 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3000 -2.8930 -4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -3.3990 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -2.3900 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -3.3860 -5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -4.0210 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -2.6530 -8.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -3.6060 -7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 0.4410 -6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -0.1640 -7.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 0.0640 -5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -0.9050 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -1.4710 -5.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -2.0120 -5.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -1.5540 -7.0920 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1470 -1.3170 -7.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -1.7130 -6.4040 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 47 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 48 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 47 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 48 1 M END