C,1,56.33,s,
O,2,,,
C,3,148.07,s,
C,4,108.87,s,
C,5,133.6,s,
C,6,43.9,s,
C,7,47.53,s,
C,8,172.96,s,
O,9,,,
O,10,,,
C,11,77.06,s,
C,12,35.12,s,
C,13,37.64,s,
C,14,32.51,s,
C,15,18.38,s,
C,16,62.6,s,
N,17,,,
C,18,44.97,s,
C,19,53.83,s,
C,20,40.4,s,
C,21,42.36,s,
C,22,15.05,s,
C,23,40.8,s,
C,24,139.0,s,
C,25,126.35,s,
C,26,115.22,s,
C,27,155.21,s,
O,28,,,
C,29,115.22,s,
C,30,126.35,s,
C,31,47.53,s,
C,32,172.96,s,
O,33,,,
O,34,,,
C,35,77.06,s,
C,36,35.12,s,
C,37,37.64,s,
C,38,32.51,s,
C,39,18.38,s,
C,40,62.6,s,
N,41,,,
C,42,44.97,s,
C,43,53.83,s,
C,44,40.4,s,
C,45,42.36,s,
C,46,15.05,s,
C,47,118.9,s,
C,48,115.36,s,
C,49,145.53,s,
O,50,,,
H,51,3.86,s,
H,52,3.86,s,
H,53,3.86,s,
H,54,6.65,dd,"1.9,0.5"
H,55,2.83,dd,"10.1,9.1"
H,56,2.7,dd,"10.1,9.6"
H,57,5.22,ddd,"11.0,6.9,3.3"
H,58,1.98,ddd,"12.4,11.0,10.6"
H,59,1.98,ddd,"12.4,6.9,4.2"
H,60,1.55,m,
H,61,2.78,m,
H,62,1.04,d,6.5
H,63,1.04,d,6.5
H,64,1.04,d,6.5
H,65,3.31,dd,"12.4,4.2"
H,66,3.31,dd,"12.4,11.3"
H,67,2.28,s,
H,68,2.28,s,
H,69,2.28,s,
H,70,3.31,dd,"12.4,3.4"
H,71,3.31,dd,"12.4,10.0"
H,72,2.83,m,
H,73,2.01,qdd,"6.6,3.3,1.3"
H,74,0.99,d,6.6
H,75,0.99,d,6.6
H,76,0.99,d,6.6
H,77,2.83,dd,"9.6,3.5"
H,78,6.96,ddd,"6.9,1.9,0.5"
H,79,6.69,ddd,"6.9,1.9,0.5"
H,80,,,
H,81,6.69,ddd,"10.1,1.9,0.5"
H,82,6.96,ddd,"10.1,1.9,0.5"
H,83,2.7,dd,"9.1,3.5"
H,84,5.22,dd,"6.9,6.2"
H,85,1.98,dd,"12.4,6.6"
H,86,1.98,ddd,"12.4,11.3,6.2"
H,87,1.55,m,
H,88,2.78,m,
H,89,1.04,d,6.5
H,90,1.04,d,6.5
H,91,1.04,d,6.5
H,92,3.31,dd,"12.4,3.6"
H,93,3.31,dd,"12.4,2.9"
H,94,2.28,s,
H,95,2.28,s,
H,96,2.28,s,
H,97,3.31,dd,"12.4,7.2"
H,98,3.31,dd,"12.4,10.2"
H,99,2.83,m,
H,100,2.01,ddq,"7.0,6.9,6.6"
H,101,0.99,d,6.6
H,102,0.99,d,6.6
H,103,0.99,d,6.6
H,104,6.96,dd,"8.0,1.9"
H,105,7.09,dd,"8.0,0.5"
H,106,,,
