PUBCHEM-ZINC03649937 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.9350 0.7800 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -0.5620 1.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7110 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.7180 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -1.9620 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -1.9380 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -0.8620 -0.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 0.2660 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 0.3970 0.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -3.2460 0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -4.0080 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -3.2700 0.7370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -3.7420 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -4.4120 -1.5820 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2570 -3.7940 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -4.6650 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -4.9390 -3.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -6.0640 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -6.8640 -3.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 -6.2770 -5.4610 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1760 -5.3710 -6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -6.6670 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 -6.8940 -6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7220 -8.1790 -7.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1790 -8.3870 -8.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3030 -7.3210 -9.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9630 -6.0370 -9.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 -5.8250 -7.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7650 -7.6640 -10.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9470 -6.6080 -11.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -5.6560 -1.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 -6.2350 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 0.7750 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 1.2820 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 1.3790 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -2.2730 2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -2.3720 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -1.4090 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 1.1920 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -5.0880 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -4.4500 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -2.8930 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 -5.5240 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8320 -3.7870 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9920 -4.2560 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0500 -7.5640 -4.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4920 -5.8840 -5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -9.0340 -6.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4530 -9.3900 -9.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0520 -5.1770 -9.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -4.8080 -7.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6870 -5.8850 -11.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 -6.1190 -11.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3300 -7.0450 -12.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 -7.3670 -6.0710 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5080 -8.1740 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -7.0510 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -7.6770 -6.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 55 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 55 1 M END