 40 
 
   C   -2.019716358   -0.137037029   -1.202865751 
   C   -1.755245428   -1.334691597   -1.887359665 
   C   -2.449250708   -2.506067651   -1.571952636 
   C   -3.405619595   -2.512242008   -0.551425490 
   C   -3.672657860   -1.323774235    0.135517448 
   C   -2.980205409   -0.151949168   -0.179502662 
   C   -4.173768805   -3.761364044   -0.236035432 
   C   -1.253675658    1.146037939   -1.493780335 
   N    0.040124541    1.068996586   -0.846578729 
   C   -1.085766059    1.413616217   -2.974591105 
   C    0.031718872    1.726520765   -3.649270399 
   C    0.244544990    1.603162675    0.403003731 
   O   -0.546272313    2.339950641    0.978681781 
   C    1.528467376    1.260819179    1.068847625 
   C    2.101145898    2.209957950    1.927427140 
   C    3.300154643    1.914810957    2.590129775 
   C    3.932741761    0.677276557    2.412299119 
   C    3.340700842   -0.266716688    1.563036368 
   C    2.139592869    0.013164906    0.893519280 
   N    3.984863710   -1.572039944    1.367954536 
   O    4.923442026   -1.866276259    2.118546423 
   O    3.551515549   -2.291040585    0.457634073 
   N    3.903182318    2.916587481    3.479494270 
   O    4.884212177    2.567834731    4.149375797 
   O    3.399869014    4.046917987    3.498129228 
   H   -1.008451823   -1.366446868   -2.677632992 
   H   -2.235536376   -3.416445491   -2.127942888 
   H   -4.418944857   -1.301753229    0.926795063 
   H   -3.189976640    0.754549021    0.387022249 
   H   -3.566991007   -4.652339114   -0.428943358 
   H   -4.460974313   -3.787226934    0.820408890 
   H   -5.078279073   -3.809317262   -0.850100571 
   H   -1.816815249    1.994856045   -1.085457558 
   H    0.698923692    0.425265466   -1.254231222 
   H   -2.013638568    1.357689928   -3.544734503 
   H   -0.006027694    1.905101125   -4.720310681 
   H    0.995563852    1.839018772   -3.165483253 
   H    1.601995692    3.169219302    2.070338936 
   H    4.865983086    0.451767825    2.927717235 
   H    1.669070886   -0.746393947    0.272320265 
