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,14,87.71,s,
N,15,,,
C,16,121.1,s,
C,17,143.45,s,
C,18,183.39,s,
O,19,,,
N,20,,,
C,21,164.42,s,
O,22,,,
C,23,74.17,s,
O,24,,,
C,25,72.74,s,
O,26,,,
C,27,73.63,s,
O,28,,,
C,29,162.55,s,
C,30,119.28,s,
C,31,122.6,s,
C,32,151.42,s,
O,33,,,
C,34,136.81,s,
N,35,,,
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,"8.9,5.1"
H,47,5.97,d,5.8
H,48,7.0,s,
H,49,9.98,s,
H,50,,,
H,51,4.53,dd,"7.6,5.8"
H,52,,,
H,53,3.94,dd,"8.9,7.6"
H,54,,,
H,55,4.0,d,5.3
H,56,,,
H,57,7.31,d,7.2
H,58,7.0,dd,"7.2,1.9"
H,59,,,
H,60,7.92,d,1.9
