C,1,22.54,s,
C,2,28.03,s,
C,3,22.54,s,
C,4,34.62,s,
C,5,33.5,s,
C,6,71.11,s,
O,7,,,
C,8,42.36,s,
C,9,15.05,s,
C,10,54.73,s,
C,11,71.11,s,
O,12,,,
C,13,43.0,s,
C,14,56.34,s,
C,15,32.9,s,
C,16,32.1,s,
C,17,125.05,s,
C,18,138.65,s,
C,19,38.83,s,
C,20,74.63,s,
O,21,,,
C,22,102.83,s,
O,23,,,
C,24,75.9,s,
C,25,62.49,s,
O,26,,,
C,27,70.68,s,
O,28,,,
C,29,77.38,s,
O,30,,,
C,31,73.99,s,
O,32,,,
C,33,36.69,s,
C,34,84.2,s,
O,35,,,
C,36,106.59,s,
O,37,,,
C,38,72.54,s,
C,39,18.25,s,
C,40,73.88,s,
O,41,,,
C,42,78.18,s,
O,43,,,
C,44,75.76,s,
O,45,,,
C,46,42.8,s,
C,47,14.9,s,
C,48,50.3,s,
C,49,23.9,s,
C,50,40.01,s,
C,51,40.8,s,
C,52,16.19,s,
H,53,0.88,d,6.4
H,54,0.88,d,6.4
H,55,0.88,d,6.4
H,56,1.5,m,"6.4,5.9"
H,57,0.88,d,6.4
H,58,0.88,d,6.4
H,59,0.88,d,6.4
H,60,1.22,td,"6.7,5.9"
H,61,1.22,td,"6.7,5.9"
H,62,1.8,td,"6.7,5.7"
H,63,1.8,td,"6.7,5.7"
H,64,4.19,td,"5.7,5.0"
H,65,,,
H,66,2.01,qdd,"6.6,5.7,5.0"
H,67,0.99,d,6.6
H,68,0.99,d,6.6
H,69,0.99,d,6.6
H,70,1.86,dd,"5.7,1.6"
H,71,4.43,ddd,"8.9,1.9,1.6"
H,72,,,
H,73,2.28,ddd,"12.4,10.3,8.9"
H,74,2.28,ddd,"12.4,7.6,1.9"
H,75,1.04,dt,"10.3,7.6"
H,76,1.51,m,
H,77,1.85,ddd,"15.4,10.0,2.6"
H,78,1.85,ddd,"15.4,6.1,1.9"
H,79,5.34,dd,"6.1,2.6"
H,80,2.39,dd,"15.4,1.3"
H,81,2.39,dd,"15.4,8.1"
H,82,4.73,m,
H,83,5.09,d,4.3
H,84,3.63,dt,"5.7,5.4"
H,85,4.04,d,5.4
H,86,4.04,d,5.4
H,87,,,
H,88,3.97,dd,"5.7,5.4"
H,89,,,
H,90,3.85,dd,"5.4,4.1"
H,91,,,
H,92,3.79,dd,"4.3,4.1"
H,93,,,
H,94,2.14,ddd,"12.4,9.1,3.4"
H,95,2.14,td,"12.4,7.6"
H,96,4.77,dd,"12.4,3.4"
H,97,5.28,d,0.9
H,98,4.01,dq,"7.6,6.1"
H,99,1.27,d,6.1
H,100,1.27,d,6.1
H,101,1.27,d,6.1
H,102,3.91,dd,"7.7,7.6"
H,103,,,
H,104,4.05,dd,"7.7,1.8"
H,105,,,
H,106,3.79,dd,"1.8,0.9"
H,107,,,
H,108,1.25,s,
H,109,1.25,s,
H,110,1.25,s,
H,111,1.61,ddd,"11.9,8.8,5.2"
H,112,1.47,m,
H,113,1.47,m,
H,114,1.48,ddd,"12.4,11.1,8.2"
H,115,1.48,ddd,"12.4,6.4,1.8"
H,116,0.8,s,
H,117,0.8,s,
H,118,0.8,s,
