PUBCHEM-ZINC03738354 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.1160 1.7910 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.3460 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.3680 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.8200 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -2.4050 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -3.7120 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 -4.5400 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -5.8630 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2000 -6.3650 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -5.5450 -0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 -4.2190 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 -6.0680 -0.5810 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3590 -5.2370 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -6.7850 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8890 -7.9660 -1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1830 -8.2890 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 -9.3500 -3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9680 -9.3700 -5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4270 -8.3230 -5.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -7.2580 -5.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -7.2690 -3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -6.3630 -3.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5710 -5.5210 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7150 -10.4810 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2240 -8.6900 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -7.7550 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 2.2830 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 2.3500 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 1.8490 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 0.3230 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -0.1760 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -0.3400 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 0.1550 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -1.8500 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -2.3580 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -4.1910 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -6.5040 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -7.3990 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -3.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2940 -10.1490 -3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5270 -8.3260 -7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3320 -6.4560 -5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7730 -10.2160 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3070 -10.6720 -6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6330 -11.4130 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -9.0920 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5370 -9.5380 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 -7.0120 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 -8.3210 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -6.9860 0.6190 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0110 -7.6500 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -6.4290 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 50 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END