C,1,52.5,s,
O,2,,,
C,3,177.7,s,
O,4,,,
C,5,48.9,s,
C,6,33.8,s,
C,7,56.65,s,
N,8,,,
C,9,54.8,s,
C,10,25.85,s,
C,11,29.58,s,
C,12,62.1,s,
H,13,3.55,s,
H,14,3.55,s,
H,15,3.55,s,
H,16,3.35,ddd,"12.7,9.8,5.5"
H,17,2.08,m,
H,18,2.08,m,
H,19,2.9,ddd,"9.4,4.7,0.7"
H,20,2.9,ddd,"13.2,9.4,4.8"
H,21,2.92,ddd,"10.1,9.4,1.9"
H,22,2.92,ddd,"9.8,9.4,8.6"
H,23,1.89,m,
H,24,1.89,m,
H,25,1.75,m,
H,26,1.75,m,
H,27,3.6,ddd,"9.8,9.2,6.1"
