PUBCHEM-ZINC02017686 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 0 0 0 0 0 0999 V2000 0.4730 0.6640 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -0.5470 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -0.9880 0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -1.8350 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -2.2290 -1.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -2.2550 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -2.3680 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -2.8830 0.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 -3.0760 1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 -3.1150 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -2.6870 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -2.7580 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -3.3190 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 -3.8050 -2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -3.6720 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9700 -4.4040 -3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -6.6830 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5960 -5.6530 -5.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -3.4380 -4.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -2.2500 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -4.5240 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4750 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -2.0730 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 1.0430 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.4160 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 1.4620 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.3580 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.2760 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 -3.9950 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6890 -4.9210 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4930 -3.5920 -4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -7.1740 -3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1770 -6.4480 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -7.3120 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 -4.6950 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4610 -6.1040 -5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1850 -6.3220 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -2.5300 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -2.1660 -4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -1.2360 -3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -4.6790 -4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.9260 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -4.9980 -3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -1.4200 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.5900 -5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -3.0140 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -0.9930 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -2.4510 3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -2.5430 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5340 -5.4040 -4.5400 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7380 -4.9350 -5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -3.0560 -3.3120 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7890 -2.9090 -2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 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 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 50 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 50 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 50 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 52 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 52 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 52 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 50 1 M CHG 1 52 1 M END