C,1,27.6,s,
C,2,81.2,s,
O,3,,,
C,4,196.96,s,
O,5,,,
C,6,111.5,s,
C,7,157.05,s,
C,8,32.76,s,
C,9,21.01,s,
C,10,49.76,s,
N,11,,,
C,12,49.76,s,
C,13,32.98,s,
C,14,138.21,s,
C,15,110.47,s,
C,16,146.6,s,
C,17,145.43,s,
C,18,129.52,s,
C,19,134.6,s,
O,20,,,
C,21,101.57,s,
O,22,,,
H,23,1.4,s,
H,24,1.4,s,
H,25,1.4,s,
H,26,,,
H,27,3.58,ddd,"12.4,7.6,0.4"
H,28,3.58,ddd,"12.7,12.4,9.0"
H,29,2.19,m,
H,30,2.19,m,
H,31,3.34,ddd,"12.4,4.8,1.0"
H,32,3.34,ddd,"13.2,12.4,4.9"
H,33,3.34,ddd,"13.4,5.6,2.9"
H,34,3.34,ddd,"13.4,12.3,5.6"
H,35,2.91,ddd,"13.4,12.3,5.6"
H,36,2.91,ddd,"13.4,5.6,2.9"
H,37,6.68,s,
H,38,5.88,s,
H,39,5.88,s,
