C,1,55.95,s,
O,2,,,
C,3,148.37,s,
C,4,110.47,s,
C,5,128.38,s,
C,6,138.43,s,
C,7,110.12,s,
C,8,147.8,s,
O,9,,,
C,10,56.37,s,
C,11,61.74,s,
C,12,39.41,s,
C,13,138.21,s,
C,14,125.66,s,
C,15,111.07,s,
C,16,147.38,s,
C,17,145.43,s,
C,18,126.72,s,
C,19,73.63,s,
O,20,,,
C,21,170.09,s,
C,22,21.04,s,
O,23,,,
O,24,,,
C,25,101.57,s,
O,26,,,
N,27,,,
C,28,40.95,s,
C,29,48.1,s,
C,30,29.1,s,
H,31,3.8,s,
H,32,3.8,s,
H,33,3.8,s,
H,34,6.51,d,0.5
H,35,6.47,d,0.5
H,36,3.8,s,
H,37,3.8,s,
H,38,3.8,s,
H,39,3.53,s,
H,40,3.53,s,
H,41,6.87,d,7.8
H,42,6.29,d,7.8
H,43,6.01,s,
H,44,2.04,s,
H,45,2.04,s,
H,46,2.04,s,
H,47,5.88,s,
H,48,5.88,s,
H,49,2.67,s,
H,50,2.67,s,
H,51,2.67,s,
H,52,3.34,ddd,"12.4,8.6,1.2"
H,53,3.34,ddd,"12.4,10.0,8.5"
H,54,2.85,ddd,"15.4,10.0,8.6"
H,55,2.85,ddd,"15.4,8.5,1.2"
