C,1,23.79,s,
C,2,41.86,s,
C,3,23.79,s,
C,4,155.2,s,
N,5,,,
C,6,61.74,s,
C,7,26.69,s,
C,8,175.97,s,
O,9,,,
O,10,,,
C,11,40.05,s,
S,12,,,
C,13,73.4,s,
O,14,,,
C,15,57.53,s,
C,16,34.51,s,
S,17,,,
C,18,66.9,s,
C,19,57.53,s,
C,20,34.51,s,
S,21,,,
C,22,163.15,s,
C,23,130.1,s,
C,24,127.92,s,
C,25,127.81,s,
C,26,131.88,s,
C,27,116.46,s,
C,28,158.73,s,
O,29,,,
N,30,,,
N,31,,,
H,32,1.13,s,
H,33,1.13,s,
H,34,1.13,s,
H,35,1.13,s,
H,36,1.13,s,
H,37,1.13,s,
H,38,1.41,s,
H,39,1.41,s,
H,40,1.41,s,
H,41,,,
H,42,3.57,s,
H,43,3.57,s,
H,44,4.42,d,5.0
H,45,,,
H,46,5.51,ddd,"9.8,9.3,5.0"
H,47,3.23,dd,"12.4,9.8"
H,48,3.23,dd,"12.4,9.3"
H,49,5.53,d,4.9
H,50,4.28,ddd,"10.0,9.0,4.9"
H,51,3.23,dd,"12.4,9.0"
H,52,3.23,dd,"12.4,10.0"
H,53,7.56,ddd,"6.6,1.4,0.5"
H,54,7.35,ddd,"8.2,6.6,1.4"
H,55,7.32,ddd,"8.2,6.7,1.4"
H,56,6.96,ddd,"6.7,1.4,0.5"
H,57,,,
H,58,,,
