C,1,108.83,s,
C,2,148.66,s,
C,3,42.24,s,
C,4,41.86,s,
C,5,49.84,s,
C,6,,,
O,7,,,
C,8,57.9,s,
C,9,42.2,s,
C,10,25.4,s,
C,11,62.58,s,
N,12,,,
C,13,42.3,s,
C,14,61.05,s,
C,15,40.4,s,
C,16,,,
O,17,,,
C,18,51.94,s,
C,19,32.61,s,
C,20,53.0,s,
C,21,41.86,s,
C,22,42.83,s,
C,23,68.6,s,
O,24,,,
C,25,77.86,s,
O,26,,,
H,27,4.83,s,
H,28,4.83,s,
H,29,2.43,s,
H,30,2.43,s,
H,31,2.57,s,
H,32,2.57,s,
H,33,2.83,s,
H,34,1.18,s,
H,35,1.18,s,
H,36,1.18,s,
H,37,3.17,s,
H,38,3.17,s,
H,39,2.36,s,
H,40,2.36,s,
H,41,2.36,s,
H,42,3.54,d,3.4
H,43,2.83,d,3.4
H,44,2.62,dd,"4.2,3.2"
H,45,1.66,ddd,"12.4,4.2,1.7"
H,46,1.66,ddd,"12.4,10.5,3.2"
H,47,2.83,dd,"10.5,1.7"
H,48,2.1,dd,"12.4,8.7"
H,49,2.1,dd,"12.4,7.6"
H,50,4.3,ddd,"8.7,7.6,4.0"
H,51,,,
H,52,4.13,d,4.0
H,53,,,
