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,11,77.06,s,
O,12,,,
C,13,104.46,s,
O,14,,,
C,15,69.74,s,
C,16,18.25,s,
C,17,73.88,s,
O,18,,,
C,19,72.26,s,
O,20,,,
C,21,73.99,s,
O,22,,,
C,23,32.57,s,
C,24,56.34,s,
C,25,32.9,s,
C,26,32.1,s,
C,27,124.9,s,
C,28,139.3,s,
C,29,43.7,s,
C,30,68.0,s,
O,31,,,
C,32,37.8,s,
C,33,84.2,s,
O,34,,,
C,35,105.97,s,
O,36,,,
C,37,78.11,s,
C,38,62.49,s,
O,39,,,
C,40,70.68,s,
O,41,,,
C,42,78.33,s,
O,43,,,
C,44,75.35,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,"5.7,1.0"
H,71,4.88,ddd,"7.5,1.8,1.0"
H,72,5.28,d,0.9
H,73,4.01,qd,"6.1,4.1"
H,74,1.27,d,6.1
H,75,1.27,d,6.1
H,76,1.27,d,6.1
H,77,3.91,dd,"8.9,4.1"
H,78,,,
H,79,4.05,dd,"8.9,3.4"
H,80,,,
H,81,3.79,dd,"3.4,0.9"
H,82,,,
H,83,2.02,ddd,"12.4,4.8,1.8"
H,84,2.02,ddd,"12.4,11.6,7.5"
H,85,1.04,ddd,"11.6,9.2,4.8"
H,86,1.51,m,
H,87,1.85,ddd,"15.4,12.6,3.1"
H,88,1.85,ddd,"15.4,7.3,4.5"
H,89,5.34,dd,"4.5,3.1"
H,90,2.44,dd,"15.4,8.6"
H,91,2.44,dd,"15.4,6.0"
H,92,3.93,m,
H,93,,,
H,94,2.12,ddd,"12.4,3.8,1.7"
H,95,2.12,ddd,"12.4,11.1,5.7"
H,96,4.77,dd,"5.7,1.7"
H,97,4.75,d,7.2
H,98,3.63,td,"5.4,1.3"
H,99,4.04,d,5.4
H,100,4.04,d,5.4
H,101,,,
H,102,3.97,dd,"4.4,1.3"
H,103,,,
H,104,3.85,dd,"4.4,1.5"
H,105,,,
H,106,3.71,dd,"7.2,1.5"
H,107,,,
H,108,1.25,s,
H,109,1.25,s,
H,110,1.25,s,
H,111,1.61,ddd,"10.4,8.6,5.1"
H,112,1.47,ddt,"12.4,10.1,8.6"
H,113,1.47,m,
H,114,1.48,ddd,"12.4,10.1,8.9"
H,115,1.48,ddd,"12.4,8.6,1.7"
H,116,0.8,s,
H,117,0.8,s,
H,118,0.8,s,
