C,1,19.81,s,
C,2,40.5,s,
C,3,19.81,s,
C,4,78.83,s,
O,5,,,
C,6,30.37,s,
C,7,32.0,s,
C,8,26.05,s,
C,9,29.9,s,
C,10,20.0,s,
C,11,26.28,s,
C,12,34.08,s,
C,13,45.37,s,
C,14,17.74,s,
C,15,50.54,s,
C,16,41.19,s,
C,17,70.43,s,
O,18,,,
C,19,178.1,s,
O,20,,,
C,21,37.39,s,
C,22,27.73,s,
C,23,34.46,s,
C,24,48.83,s,
C,25,19.28,s,
C,26,48.0,s,
C,27,26.65,s,
C,28,21.1,s,
C,29,47.1,s,
H,30,0.89,s,
H,31,0.89,s,
H,32,0.89,s,
H,33,0.89,s,
H,34,0.89,s,
H,35,0.89,s,
H,36,3.29,dd,"6.7,1.5"
H,37,,,
H,38,1.66,m,
H,39,1.66,m,
H,40,1.41,ddd,"12.4,10.3,9.1"
H,41,1.41,ddd,"12.4,9.3,0.3"
H,42,0.46,s,
H,43,0.46,s,
H,44,1.57,ddd,"12.4,11.8,4.2"
H,45,1.57,ddd,"12.4,11.9,2.7"
H,46,1.63,ddd,"12.4,11.9,4.2"
H,47,1.63,ddd,"12.4,11.8,2.7"
H,48,1.12,s,
H,49,1.12,s,
H,50,1.12,s,
H,51,2.21,ddd,"10.9,9.4,5.6"
H,52,2.3,m,
H,53,4.04,dd,"12.4,9.4"
H,54,4.04,dd,"12.4,3.5"
H,55,2.6,d,18.4
H,56,2.6,dd,"18.4,7.9"
H,57,1.72,m,
H,58,1.72,m,
H,59,1.39,ddd,"12.4,11.1,7.8"
H,60,1.39,ddd,"12.4,11.8,2.7"
H,61,0.93,s,
H,62,0.93,s,
H,63,0.93,s,
H,64,1.5,dd,"12.2,3.7"
H,65,1.2,m,
H,66,1.2,m,
H,67,1.2,m,
H,68,1.2,m,
H,69,1.3,dd,"13.2,3.9"
