C,1,15.88,s,
C,2,35.85,s,
C,3,65.34,s,
O,4,,,
C,5,109.5,s,
O,6,,,
C,7,83.52,s,
C,8,35.0,s,
C,9,50.54,s,
C,10,37.2,s,
C,11,32.18,s,
C,12,122.3,s,
C,13,140.22,s,
C,14,39.04,s,
C,15,79.4,s,
O,16,,,
C,17,99.9,s,
O,18,,,
C,19,77.41,s,
C,20,62.57,s,
O,21,,,
C,22,72.07,s,
O,23,,,
C,24,78.08,s,
O,25,,,
C,26,78.67,s,
O,27,,,
C,28,101.9,s,
O,29,,,
C,30,69.42,s,
C,31,18.25,s,
C,32,73.88,s,
O,33,,,
C,34,71.76,s,
O,35,,,
C,36,71.77,s,
O,37,,,
C,38,30.06,s,
C,39,37.28,s,
C,40,36.41,s,
C,41,18.71,s,
C,42,50.54,s,
C,43,29.06,s,
C,44,76.1,s,
O,45,,,
C,46,48.25,s,
C,47,12.21,s,
C,48,84.99,s,
O,49,,,
C,50,40.4,s,
C,51,18.87,s,
C,52,68.29,s,
O,53,,,
C,54,36.82,s,
H,55,0.77,d,6.4
H,56,0.77,d,6.4
H,57,0.77,d,6.4
H,58,2.02,m,
H,59,3.48,dd,"9.4,7.6"
H,60,3.48,dd,"10.9,9.4"
H,61,4.04,dd,"7.7,1.2"
H,62,1.9,ddd,"12.4,8.3,1.2"
H,63,1.9,ddd,"12.4,10.3,7.7"
H,64,1.61,ddd,"10.3,8.6,8.3"
H,65,1.86,m,
H,66,1.85,ddd,"15.4,6.7,5.5"
H,67,1.85,ddd,"15.4,12.2,2.6"
H,68,5.34,dd,"5.5,2.6"
H,69,2.4,dd,"15.4,8.8"
H,70,2.4,dd,"15.4,5.8"
H,71,3.79,m,
H,72,4.94,d,5.5
H,73,3.84,dt,"8.1,5.4"
H,74,4.04,d,5.4
H,75,4.04,d,5.4
H,76,,,
H,77,4.23,dd,"8.1,6.7"
H,78,,,
H,79,4.2,dd,"7.9,6.7"
H,80,,,
H,81,4.29,dd,"7.9,5.5"
H,82,5.3,d,0.4
H,83,4.01,qd,"6.1,2.1"
H,84,1.27,d,6.1
H,85,1.27,d,6.1
H,86,1.27,d,6.1
H,87,3.91,dd,"2.1,2.0"
H,88,,,
H,89,4.05,dd,"4.1,2.0"
H,90,,,
H,91,4.22,dd,"4.1,0.4"
H,92,,,
H,93,1.94,m,
H,94,1.94,m,
H,95,1.61,ddd,"12.4,11.7,7.8"
H,96,1.61,ddd,"12.4,7.3,2.0"
H,97,1.0,s,
H,98,1.0,s,
H,99,1.0,s,
H,100,1.61,ddd,"11.5,6.3,2.5"
H,101,1.86,ddd,"12.4,2.7,2.5"
H,102,1.86,ddd,"12.4,11.5,2.5"
H,103,4.12,dd,"2.7,2.5"
H,104,,,
H,105,1.46,s,
H,106,1.46,s,
H,107,1.46,s,
H,108,,,
H,109,2.41,q,6.8
H,110,1.02,d,6.8
H,111,1.02,d,6.8
H,112,1.02,d,6.8
H,113,3.5,dd,"12.6,3.9"
H,114,,,
H,115,1.66,ddd,"12.4,3.9,0.6"
H,116,1.66,ddd,"12.6,12.4,8.3"
