C,1,55.95,s,
O,2,,,
C,3,147.53,s,
C,4,111.48,s,
C,5,127.39,s,
C,6,131.87,s,
C,7,110.33,s,
C,8,147.4,s,
O,9,,,
C,10,55.78,s,
C,11,59.8,s,
C,12,80.64,s,
O,13,,,
C,14,167.6,s,
O,15,,,
C,16,110.3,s,
C,17,140.95,s,
C,18,116.8,s,
C,19,113.1,s,
C,20,149.1,s,
C,21,144.5,s,
O,22,,,
C,23,103.3,s,
O,24,,,
N,25,,,
C,26,41.67,s,
C,27,27.74,s,
H,28,3.8,s,
H,29,3.8,s,
H,30,3.8,s,
H,31,6.55,d,0.5
H,32,6.64,d,0.5
H,33,3.8,s,
H,34,3.8,s,
H,35,3.8,s,
H,36,5.43,d,5.3
H,37,5.11,d,5.3
H,38,7.22,d,6.7
H,39,6.55,d,6.7
H,40,5.88,s,
H,41,5.88,s,
H,42,,,
H,43,3.09,ddd,"12.4,10.1,8.5"
H,44,3.09,ddd,"12.4,10.6,1.1"
H,45,2.78,ddd,"15.4,10.6,8.5"
H,46,2.78,ddd,"15.4,10.1,1.1"
