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,7,72.09,s,
O,8,,,
C,9,72.07,s,
O,10,,,
C,11,77.41,s,
C,12,62.57,s,
O,13,,,
O,14,,,
C,15,99.9,s,
O,16,,,
C,17,79.4,s,
C,18,30.2,s,
C,19,37.49,s,
C,20,37.5,s,
C,21,19.42,s,
C,22,140.68,s,
C,23,122.0,s,
C,24,32.8,s,
C,25,31.6,s,
C,26,50.8,s,
C,27,21.06,s,
C,28,40.11,s,
C,29,40.79,s,
C,30,16.66,s,
C,31,56.49,s,
C,32,32.26,s,
C,33,78.73,s,
O,34,,,
C,35,98.53,s,
C,36,31.73,s,
C,37,29.38,s,
C,38,30.61,s,
C,39,19.2,s,
C,40,47.94,s,
N,41,,,
C,42,41.73,s,
C,43,15.24,s,
C,44,62.66,s,
C,45,38.9,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,qd,"6.1,1.4"
H,56,5.3,d,1.8
H,57,4.29,dd,"1.3,1.0"
H,58,4.21,dd,"5.3,1.3"
H,59,,,
H,60,4.23,dd,"5.3,5.0"
H,61,,,
H,62,3.84,td,"5.4,5.0"
H,63,4.04,d,5.4
H,64,4.04,d,5.4
H,65,,,
H,66,4.94,d,1.0
H,67,3.79,m,
H,68,1.94,m,
H,69,1.94,m,
H,70,1.61,ddd,"12.4,4.9,4.8"
H,71,1.61,ddd,"14.0,12.4,4.1"
H,72,0.99,s,
H,73,0.99,s,
H,74,0.99,s,
H,75,5.34,dd,"6.1,2.7"
H,76,1.79,ddd,"15.4,12.3,2.7"
H,77,1.79,ddd,"15.4,6.1,2.9"
H,78,1.64,m,
H,79,0.94,ddd,"13.4,9.1,1.0"
H,80,1.5,m,
H,81,1.5,m,
H,82,1.45,ddd,"12.9,12.4,8.2"
H,83,1.45,ddd,"12.4,5.4,1.8"
H,84,1.04,s,
H,85,1.04,s,
H,86,1.04,s,
H,87,1.1,ddd,"12.7,9.9,6.0"
H,88,2.02,ddd,"12.7,12.4,7.6"
H,89,2.02,ddd,"12.4,6.0,1.4"
H,90,4.88,ddd,"9.3,7.6,1.4"
H,91,2.1,ddd,"12.4,11.5,1.6"
H,92,2.1,ddd,"12.4,11.8,4.9"
H,93,1.58,m,
H,94,1.58,m,
H,95,2.13,m,
H,96,0.82,d,6.4
H,97,0.82,d,6.4
H,98,0.82,d,6.4
H,99,3.21,dd,"12.4,9.6"
H,100,3.21,dd,"12.4,5.9"
H,101,,,
H,102,2.83,dq,"7.2,6.7"
H,103,1.03,d,6.7
H,104,1.03,d,6.7
H,105,1.03,d,6.7
H,106,1.86,dd,"9.3,7.2"
H,107,2.4,dd,"15.4,2.2"
H,108,2.4,dd,"15.4,7.5"
H,109,4.22,dd,"4.2,1.8"
H,110,,,
H,111,4.05,dd,"5.7,4.2"
H,112,,,
H,113,3.91,dd,"5.7,1.4"
H,114,,,
