 46 
 
   C    0.167558606   -0.808953489    1.607503385 
   C    0.525626076   -2.110825736    2.056719673 
   C    0.537677871   -2.397322708    3.436925199 
   C    0.227370302   -1.428810896    4.390163649 
   C   -0.078654019   -0.140510544    3.958689213 
   C   -0.113758538    0.184589437    2.590172949 
   C    0.285841052   -1.751140497    5.853628793 
   O    3.019906841   -0.007419600   -2.036827959 
   C    0.855985365   -3.259161522    1.136742256 
   C    0.116035853   -0.427433131    0.124624449 
   N    1.453968342   -0.378195574   -0.444792915 
   C   -0.754323007   -1.317524675   -0.728975413 
   C   -2.024356557   -1.043642261   -1.063708148 
   C    1.877524256    0.161726559   -1.626750411 
   C    0.943347740    0.949385693   -2.449158957 
   C   -0.459508918    1.609654858    2.231649899 
   C    0.448323261    2.168905817   -1.980157114 
   C   -0.425867687    2.903948523   -2.789982192 
   C   -0.788365039    2.445154894   -4.064302514 
   C   -0.256679899    1.230661288   -4.523259374 
   C    0.615429900    0.480401231   -3.724785588 
   N   -0.977497593    4.166994267   -2.287397478 
   O   -1.544058092    4.908376457   -3.099951077 
   O   -0.850329393    4.403016897   -1.078249874 
   N   -0.626063631    0.733488645   -5.854815240 
   O   -0.254325799   -0.405344997   -6.166296510 
   O   -1.295597069    1.482047734   -6.578600616 
   H    0.795531549   -3.400805722    3.774575257 
   H   -0.295870829    0.625995852    4.701505967 
   H    0.022494056   -2.798691705    6.034077219 
   H    1.294418845   -1.568582475    6.237041823 
   H   -0.423979095   -1.137234148    6.418043753 
   H    1.411482372   -4.042012262    1.666114418 
   H   -0.063786188   -3.709541384    0.751898481 
   H    1.495983896   -2.950254512    0.307771553 
   H   -0.292466513    0.578783470    0.024210801 
   H    2.180137220   -0.882080568    0.048871885 
   H   -0.306266487   -2.221638815   -1.133464167 
   H   -2.589954242   -1.724016491   -1.694165456 
   H   -2.535073701   -0.156874607   -0.700605311 
   H   -1.401225686    1.644161176    1.674690020 
   H   -0.587002576    2.233116315    3.123367404 
   H    0.344115580    2.059907069    1.640264364 
   H    0.754387715    2.533642002   -1.001086314 
   H   -1.470764113    3.022856686   -4.687264120 
   H    1.042623144   -0.458795722   -4.074656676 
