C,1,18.52,s,
C,2,35.16,s,
C,3,35.12,s,
C,4,76.51,s,
O,5,,,
C,6,109.5,s,
O,7,,,
C,8,78.54,s,
C,9,72.42,s,
C,10,25.27,s,
C,11,25.27,s,
O,12,,,
C,13,50.05,s,
C,14,43.99,s,
C,15,17.82,s,
C,16,32.64,s,
C,17,26.31,s,
C,18,23.81,s,
C,19,29.97,s,
C,20,26.22,s,
C,21,32.2,s,
C,22,30.1,s,
C,23,88.1,s,
O,24,,,
C,25,107.2,s,
O,26,,,
C,27,66.5,s,
C,28,68.28,s,
O,29,,,
C,30,84.12,s,
O,31,,,
C,32,106.3,s,
O,33,,,
C,34,66.85,s,
C,35,70.91,s,
O,36,,,
C,37,75.5,s,
O,38,,,
C,39,73.75,s,
O,40,,,
C,41,71.3,s,
O,42,,,
C,43,41.4,s,
C,44,20.96,s,
C,45,20.96,s,
C,46,47.9,s,
C,47,20.79,s,
C,48,23.21,s,
C,49,51.21,s,
C,50,47.72,s,
C,51,17.01,s,
C,52,73.63,s,
O,53,,,
H,54,0.92,d,6.5
H,55,0.92,d,6.5
H,56,0.92,d,6.5
H,57,1.68,m,
H,58,1.88,ddd,"12.5,12.4,3.0"
H,59,1.88,ddd,"12.4,9.4,5.9"
H,60,4.61,ddd,"9.4,3.9,3.0"
H,61,4.76,d,3.9
H,62,1.33,s,
H,63,1.33,s,
H,64,1.33,s,
H,65,1.33,s,
H,66,1.33,s,
H,67,1.33,s,
H,68,,,
H,69,3.22,d,11.6
H,70,1.02,s,
H,71,1.02,s,
H,72,1.02,s,
H,73,2.01,ddd,"13.0,12.4,3.1"
H,74,2.01,ddd,"12.4,4.0,2.1"
H,75,1.7,ddd,"13.0,12.4,2.1"
H,76,1.7,ddd,"12.4,4.0,3.1"
H,77,0.46,s,
H,78,0.46,s,
H,79,1.54,ddd,"13.5,12.4,3.8"
H,80,1.54,ddd,"12.4,4.4,3.7"
H,81,2.34,m,
H,82,2.34,m,
H,83,3.47,dd,"5.8,1.8"
H,84,4.5,d,6.3
H,85,4.06,dd,"9.5,9.4"
H,86,4.06,dd,"9.4,5.4"
H,87,4.04,ddd,"10.5,9.5,5.4"
H,88,,,
H,89,3.72,dd,"10.5,1.9"
H,90,4.82,d,7.4
H,91,4.14,dd,"9.4,0.8"
H,92,4.14,dd,"9.4,5.8"
H,93,4.09,ddd,"5.8,3.0,0.8"
H,94,,,
H,95,4.04,dd,"6.5,3.0"
H,96,,,
H,97,3.89,dd,"7.4,6.5"
H,98,,,
H,99,3.6,dd,"6.3,1.9"
H,100,,,
H,101,1.14,s,
H,102,1.14,s,
H,103,1.14,s,
H,104,1.14,s,
H,105,1.14,s,
H,106,1.14,s,
H,107,1.26,dd,"7.7,1.9"
H,108,0.93,m,
H,109,0.93,m,
H,110,1.34,m,
H,111,1.34,m,
H,112,1.77,dd,"10.0,8.2"
H,113,1.25,s,
H,114,1.25,s,
H,115,1.25,s,
H,116,4.52,s,
H,117,,,
