C,1,18.25,s,
C,2,69.42,s,
O,3,,,
C,4,101.9,s,
O,5,,,
C,6,78.67,s,
C,7,69.4,s,
O,8,,,
C,9,73.4,s,
O,10,,,
C,11,69.1,s,
C,12,17.6,s,
O,13,,,
C,14,103.29,s,
O,15,,,
C,16,84.2,s,
C,17,37.8,s,
C,18,68.0,s,
O,19,,,
C,20,43.7,s,
C,21,139.3,s,
C,22,124.9,s,
C,23,32.0,s,
C,24,32.9,s,
C,25,56.7,s,
C,26,32.0,s,
C,27,80.95,s,
O,28,,,
C,29,109.25,s,
C,30,31.65,s,
C,31,29.05,s,
C,32,30.45,s,
C,33,17.25,s,
C,34,66.9,s,
O,35,,,
C,36,41.8,s,
C,37,14.75,s,
C,38,62.65,s,
C,39,40.25,s,
C,40,16.4,s,
C,41,40.5,s,
C,42,23.9,s,
C,43,50.3,s,
C,44,42.8,s,
C,45,14.9,s,
C,46,71.77,s,
O,47,,,
C,48,71.76,s,
O,49,,,
C,50,73.88,s,
O,51,,,
H,52,1.27,d,6.1
H,53,1.27,d,6.1
H,54,1.27,d,6.1
H,55,4.01,dq,"8.2,6.1"
H,56,5.3,d,1.8
H,57,4.29,dd,"2.5,1.7"
H,58,4.05,dd,"8.2,1.7"
H,59,,,
H,60,3.83,dd,"8.2,3.1"
H,61,,,
H,62,3.81,qd,"6.1,3.1"
H,63,1.27,d,6.1
H,64,1.27,d,6.1
H,65,1.27,d,6.1
H,66,5.14,d,2.5
H,67,4.77,dd,"4.2,2.7"
H,68,2.12,ddd,"12.4,4.2,2.2"
H,69,2.12,ddd,"12.4,9.2,2.7"
H,70,3.93,m,
H,71,,,
H,72,2.44,dd,"15.4,8.9"
H,73,2.44,dd,"15.4,7.7"
H,74,5.34,dd,"4.6,3.1"
H,75,1.85,ddd,"15.4,6.1,4.6"
H,76,1.85,ddd,"15.4,10.4,3.1"
H,77,1.51,m,
H,78,1.1,ddd,"11.4,10.1,8.0"
H,79,1.64,ddd,"12.4,10.1,3.4"
H,80,1.64,ddd,"12.4,9.7,8.0"
H,81,4.38,ddd,"9.7,6.7,3.4"
H,82,1.63,ddd,"12.4,4.9,3.5"
H,83,1.63,ddd,"14.1,12.4,5.7"
H,84,1.53,m,
H,85,1.53,m,
H,86,1.62,m,
H,87,0.87,d,6.4
H,88,0.87,d,6.4
H,89,0.87,d,6.4
H,90,3.42,dd,"9.4,4.8"
H,91,3.42,dd,"11.5,9.4"
H,92,1.87,qd,"6.7,0.9"
H,93,0.98,d,6.7
H,94,0.98,d,6.7
H,95,0.98,d,6.7
H,96,1.78,dd,"6.7,0.9"
H,97,0.78,s,
H,98,0.78,s,
H,99,0.78,s,
H,100,1.48,ddd,"12.4,10.3,8.5"
H,101,1.48,ddd,"12.4,7.7,1.6"
H,102,1.47,m,
H,103,1.47,m,
H,104,1.61,td,"11.5,5.9"
H,105,1.25,s,
H,106,1.25,s,
H,107,1.25,s,
H,108,4.22,dd,"2.6,1.8"
H,109,,,
H,110,4.05,dd,"6.6,2.6"
H,111,,,
H,112,3.91,dd,"8.2,6.6"
H,113,,,
