C,1,51.13,s,
O,2,,,
C,3,177.67,s,
O,4,,,
C,5,45.7,s,
C,6,32.2,s,
C,7,32.9,s,
C,8,31.1,s,
C,9,28.34,s,
C,10,28.34,s,
C,11,45.7,s,
C,12,40.8,s,
C,13,142.7,s,
C,14,121.5,s,
C,15,23.3,s,
C,16,48.1,s,
C,17,37.85,s,
C,18,16.5,s,
C,19,36.75,s,
C,20,27.9,s,
C,21,74.88,s,
O,22,,,
C,23,43.95,s,
C,24,19.83,s,
C,25,67.82,s,
O,26,,,
C,27,53.8,s,
C,28,19.7,s,
C,29,33.41,s,
C,30,39.2,s,
C,31,16.87,s,
C,32,39.1,s,
C,33,26.08,s,
C,34,29.8,s,
C,35,22.5,s,
H,36,3.66,s,
H,37,3.66,s,
H,38,3.66,s,
H,39,1.82,ddd,"12.4,11.8,8.3"
H,40,1.82,ddd,"12.4,6.4,1.6"
H,41,2.25,ddd,"12.4,8.3,1.6"
H,42,2.25,ddd,"12.4,11.8,6.4"
H,43,0.94,s,
H,44,0.94,s,
H,45,0.94,s,
H,46,0.94,s,
H,47,0.94,s,
H,48,0.94,s,
H,49,1.58,dd,"12.4,6.5"
H,50,1.58,dd,"12.4,1.8"
H,51,3.17,dd,"6.5,1.8"
H,52,5.43,dd,"5.7,2.7"
H,53,2.0,ddd,"15.4,5.7,4.0"
H,54,2.0,ddd,"15.4,11.6,2.7"
H,55,1.81,dd,"11.6,4.0"
H,56,0.9,s,
H,57,0.9,s,
H,58,0.9,s,
H,59,1.19,ddd,"12.4,11.3,4.5"
H,60,1.19,ddd,"12.4,11.5,2.2"
H,61,1.86,m,
H,62,1.86,m,
H,63,3.69,dd,"7.6,1.6"
H,64,,,
H,65,1.18,s,
H,66,1.18,s,
H,67,1.18,s,
H,68,3.77,s,
H,69,3.77,s,
H,70,,,
H,71,0.95,dd,"10.8,2.6"
H,72,1.52,m,
H,73,1.52,m,
H,74,1.47,ddd,"12.4,10.6,8.0"
H,75,1.47,ddd,"12.4,9.3,1.5"
H,76,1.08,s,
H,77,1.08,s,
H,78,1.08,s,
H,79,1.27,s,
H,80,1.27,s,
H,81,1.27,s,
H,82,1.65,ddd,"13.6,12.4,2.1"
H,83,1.65,ddd,"12.4,6.7,2.7"
H,84,2.31,ddd,"13.6,12.4,2.7"
H,85,2.31,ddd,"12.4,6.7,2.1"
