C,1,52.29,s,
O,2,,,
C,3,174.33,s,
O,4,,,
C,5,47.03,s,
C,6,49.84,s,
C,7,,,
O,8,,,
C,9,48.88,s,
C,10,29.4,s,
C,11,20.29,s,
C,12,20.29,s,
C,13,43.37,s,
C,14,,,
O,15,,,
C,16,45.99,s,
C,17,18.5,s,
C,18,26.84,s,
C,19,25.99,s,
C,20,37.0,s,
C,21,29.4,s,
C,22,19.9,s,
C,23,43.37,s,
C,24,,,
O,25,,,
C,26,58.38,s,
C,27,43.98,s,
C,28,132.74,s,
C,29,135.3,s,
C,30,23.8,s,
C,31,35.68,s,
C,32,27.6,s,
C,33,83.52,s,
O,34,,,
C,35,83.52,s,
C,36,19.7,s,
C,37,34.9,s,
C,38,73.7,s,
C,39,24.74,s,
O,40,,,
C,41,73.7,s,
C,42,24.74,s,
O,43,,,
C,44,40.59,s,
C,45,73.18,s,
O,46,,,
C,47,147.7,s,
C,48,137.08,s,
C,49,19.61,s,
C,50,42.24,s,
H,51,3.63,s,
H,52,3.63,s,
H,53,3.63,s,
H,54,2.57,s,
H,55,2.57,s,
H,56,3.82,ddd,"12.9,5.5,3.1"
H,57,1.87,m,"6.4,5.5"
H,58,0.88,d,6.4
H,59,0.88,d,6.4
H,60,0.88,d,6.4
H,61,0.88,d,6.4
H,62,0.88,d,6.4
H,63,0.88,d,6.4
H,64,2.74,dd,"15.4,3.1"
H,65,2.74,dd,"15.4,12.9"
H,66,2.78,dqd,"9.2,6.6,0.7"
H,67,1.12,d,6.6
H,68,1.12,d,6.6
H,69,1.12,d,6.6
H,70,1.56,m,
H,71,1.56,m,
H,72,1.42,m,
H,73,1.42,m,
H,74,1.23,m,
H,75,1.23,m,
H,76,2.09,m,
H,77,0.94,d,6.4
H,78,0.94,d,6.4
H,79,0.94,d,6.4
H,80,2.74,dd,"15.4,11.8"
H,81,2.74,dd,"15.4,2.1"
H,82,2.39,d,8.3
H,83,3.63,dd,"8.3,3.4"
H,84,5.92,d,3.4
H,85,1.71,s,
H,86,1.71,s,
H,87,1.71,s,
H,88,2.21,ddd,"15.4,11.7,7.6"
H,89,2.21,ddd,"15.4,5.7,3.2"
H,90,1.91,m,
H,91,1.91,m,
H,92,4.54,dd,"9.5,8.5"
H,93,4.54,dd,"10.6,3.6"
H,94,1.8,m,
H,95,1.8,m,
H,96,1.9,ddd,"12.8,12.4,7.4"
H,97,1.9,ddd,"12.4,6.7,2.6"
H,98,1.36,s,
H,99,1.36,s,
H,100,1.36,s,
H,101,,,
H,102,1.36,s,
H,103,1.36,s,
H,104,1.36,s,
H,105,,,
H,106,2.27,dd,"12.4,3.9"
H,107,2.27,dd,"12.4,11.6"
H,108,4.37,dd,"11.6,3.9"
H,109,,,
H,110,1.88,s,
H,111,1.88,s,
H,112,1.88,s,
H,113,2.43,s,
H,114,2.43,s,
