C,1,57.81,s,
O,2,,,
C,3,73.63,s,
C,4,70.48,s,
O,5,,,
C,6,38.31,s,
C,7,83.38,s,
O,8,,,
C,9,94.2,s,
C,10,28.8,s,
N,11,,,
C,12,139.5,s,
C,13,113.4,s,
C,14,126.5,s,
C,15,120.8,s,
C,16,127.2,s,
C,17,124.5,s,
C,18,115.87,s,
C,19,130.1,s,
C,20,133.8,s,
C,21,128.89,s,
C,22,125.9,s,
C,23,122.8,s,
C,24,122.0,s,
C,25,126.5,s,
C,26,109.4,s,
C,27,137.8,s,
N,28,,,
C,29,130.91,s,
C,30,130.91,s,
C,31,50.28,s,
N,32,,,
C,33,162.36,s,
O,34,,,
H,35,3.42,s,
H,36,3.42,s,
H,37,3.42,s,
H,38,4.26,d,10.6
H,39,4.17,ddd,"11.9,10.6,2.2"
H,40,,,
H,41,2.67,ddd,"12.4,8.4,2.2"
H,42,2.67,ddd,"12.4,11.9,11.3"
H,43,6.54,dd,"11.3,8.4"
H,44,2.52,s,
H,45,2.52,s,
H,46,2.52,s,
H,47,8.04,ddd,"8.8,1.4,0.5"
H,48,7.53,ddd,"8.8,6.4,1.4"
H,49,7.34,ddd,"9.5,6.4,1.4"
H,50,9.31,ddd,"9.5,1.4,0.5"
H,51,8.01,ddd,"6.9,1.4,0.5"
H,52,7.41,ddd,"8.0,6.9,1.4"
H,53,7.54,ddd,"8.0,7.8,1.4"
H,54,7.5,ddd,"7.8,1.4,0.5"
H,55,4.61,s,
H,56,4.61,s,
H,57,,,
