C,1,18.87,s,
C,2,40.4,s,
C,3,57.53,s,
N,4,,,
C,5,162.36,s,
O,6,,,
N,7,,,
C,8,57.53,s,
C,9,174.5,s,
O,10,,,
O,11,,,
C,12,81.0,s,
O,13,,,
C,14,89.62,s,
N,15,,,
C,16,142.2,s,
C,17,103.5,s,
C,18,165.85,s,
O,19,,,
N,20,,,
C,21,152.4,s,
O,22,,,
C,23,72.86,s,
O,24,,,
C,25,72.74,s,
O,26,,,
C,27,75.17,s,
O,28,,,
C,29,141.33,s,
C,30,124.08,s,
C,31,115.85,s,
C,32,157.6,s,
O,33,,,
C,34,115.85,s,
C,35,124.08,s,
H,36,1.03,d,6.6
H,37,1.03,d,6.6
H,38,1.03,d,6.6
H,39,2.83,qdd,"6.6,5.7,5.3"
H,40,4.28,d,5.7
H,41,,,
H,42,,,
H,43,,,
H,44,5.22,d,5.1
H,45,,,
H,46,4.76,dd,"5.1,1.8"
H,47,5.85,d,9.0
H,48,7.64,d,5.7
H,49,5.39,d,5.7
H,50,,,
H,51,4.23,dd,"9.0,5.3"
H,52,,,
H,53,3.94,dd,"5.3,1.8"
H,54,,,
H,55,5.19,d,5.3
H,56,,,
H,57,7.13,ddd,"6.6,1.9,0.5"
H,58,6.81,ddd,"6.6,1.9,0.5"
H,59,,,
H,60,6.81,ddd,"8.0,1.9,0.5"
H,61,7.13,ddd,"8.0,1.9,0.5"
