C,1,56.0,s,
O,2,,,
C,3,152.6,s,
C,4,111.02,s,
C,5,124.7,s,
C,6,122.0,s,
C,7,131.53,s,
C,8,143.7,s,
O,9,,,
C,10,60.3,s,
C,11,50.5,s,
C,12,152.75,s,
C,13,127.2,s,
C,14,185.5,s,
O,15,,,
C,16,127.2,s,
C,17,152.75,s,
C,18,46.7,s,
C,19,65.2,s,
N,20,,,
C,21,43.3,s,
C,22,54.6,s,
C,23,26.8,s,
H,24,3.81,s,
H,25,3.81,s,
H,26,3.81,s,
H,27,6.61,s,
H,28,3.62,s,
H,29,3.62,s,
H,30,3.62,s,
H,31,6.88,d,11.8
H,32,6.36,d,11.8
H,33,6.36,d,12.0
H,34,6.88,d,12.0
H,35,2.15,dd,"12.4,7.9"
H,36,2.15,dd,"12.4,11.4"
H,37,4.75,dd,"11.4,7.9"
H,38,2.35,s,
H,39,2.35,s,
H,40,2.35,s,
H,41,2.78,ddd,"12.4,3.7,2.8"
H,42,2.78,ddd,"13.2,12.4,4.6"
H,43,2.85,ddd,"15.4,4.6,2.8"
H,44,2.85,ddd,"15.4,13.2,3.7"
