C,1,55.95,s,
O,2,,,
C,3,148.97,s,
C,4,110.47,s,
C,5,129.2,s,
C,6,146.19,s,
C,7,108.48,s,
C,8,148.7,s,
O,9,,,
C,10,55.84,s,
C,11,40.5,s,
C,12,35.8,s,
C,13,47.1,s,
N,14,,,
C,15,42.74,s,
C,16,62.1,s,
C,17,21.67,s,
C,18,42.9,s,
C,19,35.12,s,
C,20,78.42,s,
O,21,,,
C,22,57.6,s,
C,23,,,
O,24,,,
C,25,49.84,s,
H,26,3.8,s,
H,27,3.8,s,
H,28,3.8,s,
H,29,6.68,d,0.5
H,30,6.57,d,0.5
H,31,3.8,s,
H,32,3.8,s,
H,33,3.8,s,
H,34,2.18,ddd,"12.4,10.0,8.0"
H,35,2.18,ddd,"12.4,9.5,1.6"
H,36,2.58,ddd,"12.4,10.0,1.6"
H,37,2.58,ddd,"12.4,9.5,8.0"
H,38,2.35,s,
H,39,2.35,s,
H,40,2.35,s,
H,41,3.6,ddd,"8.0,3.7,1.6"
H,42,3.01,dd,"15.4,8.0"
H,43,3.01,dd,"15.4,1.6"
H,44,1.94,ddd,"10.0,3.7,0.9"
H,45,1.88,ddd,"12.4,7.3,0.9"
H,46,1.88,ddd,"12.4,11.5,10.0"
H,47,4.87,dd,"11.5,7.3"
H,48,3.42,s,
H,49,3.42,s,
H,50,3.42,s,
H,51,2.57,s,
H,52,2.57,s,
