C,1,19.5,s,
C,2,31.16,s,
C,3,31.4,s,
C,4,24.98,s,
C,5,62.1,s,
C,6,41.5,s,
C,7,16.6,s,
C,8,37.64,s,
C,9,31.34,s,
C,10,28.16,s,
C,11,37.9,s,
C,12,37.2,s,
C,13,36.81,s,
C,14,69.0,s,
O,15,,,
C,16,49.75,s,
C,17,35.12,s,
C,18,76.75,s,
O,19,,,
C,20,102.4,s,
O,21,,,
C,22,78.4,s,
C,23,62.49,s,
O,24,,,
C,25,70.68,s,
O,26,,,
C,27,77.38,s,
O,28,,,
C,29,75.1,s,
O,30,,,
C,31,28.87,s,
C,32,36.29,s,
C,33,37.91,s,
C,34,16.96,s,
C,35,50.54,s,
C,36,33.16,s,
C,37,37.9,s,
C,38,40.4,s,
C,39,53.83,s,
N,40,,,
C,41,53.83,s,
H,42,0.97,d,6.4
H,43,0.97,d,6.4
H,44,0.97,d,6.4
H,45,1.92,m,
H,46,1.58,m,
H,47,1.58,m,
H,48,1.84,m,
H,49,1.84,tdd,"12.4,11.8,1.6"
H,50,3.6,ddd,"12.4,8.0,4.8"
H,51,2.83,ddq,"8.0,7.3,6.6"
H,52,0.99,d,6.6
H,53,0.99,d,6.6
H,54,0.99,d,6.6
H,55,1.55,m,
H,56,1.49,m,
H,57,1.49,dtd,"13.1,12.4,6.2"
H,58,1.58,m,
H,59,1.58,m,
H,60,1.59,m,
H,61,1.86,m,
H,62,1.88,ddd,"12.4,10.7,8.8"
H,63,1.88,ddd,"12.4,6.9,1.9"
H,64,4.19,ddd,"10.4,8.8,1.9"
H,65,,,
H,66,2.12,ddd,"12.5,10.4,5.4"
H,67,1.88,ddd,"12.5,12.4,9.8"
H,68,1.88,ddd,"12.4,5.4,4.2"
H,69,3.9,m,
H,70,5.09,d,1.8
H,71,3.63,dt,"7.5,5.4"
H,72,4.04,d,5.4
H,73,4.04,d,5.4
H,74,,,
H,75,3.97,dd,"7.5,4.4"
H,76,,,
H,77,3.85,dd,"8.2,4.4"
H,78,,,
H,79,3.79,dd,"8.2,1.8"
H,80,,,
H,81,1.74,m,
H,82,1.74,m,
H,83,1.32,ddd,"13.7,12.4,3.7"
H,84,1.32,ddd,"12.4,4.3,4.0"
H,85,0.94,s,
H,86,0.94,s,
H,87,0.94,s,
H,88,1.61,ddd,"10.9,8.5,2.8"
H,89,1.83,ddd,"12.4,6.7,2.8"
H,90,1.83,ddd,"12.4,10.9,9.8"
H,91,1.59,m,
H,92,2.83,dtd,"11.4,11.1,2.9"
H,93,3.31,dd,"12.4,11.4"
H,94,3.31,dd,"12.4,2.9"
H,95,2.71,dd,"12.4,8.7"
H,96,2.71,dd,"12.4,9.2"
