C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,51.67,s,
N,5,,,
C,6,49.76,s,
C,7,38.94,s,
C,8,41.86,s,
C,9,134.28,s,
C,10,124.58,s,
C,11,122.44,s,
C,12,131.17,s,
C,13,116.11,s,
C,14,142.35,s,
N,15,,,
C,16,37.35,s,
C,17,87.49,s,
C,18,73.63,s,
O,19,,,
C,20,35.12,s,
C,21,47.74,s,
C,22,41.86,s,
C,23,67.18,s,
O,24,,,
C,25,174.33,s,
O,26,,,
O,27,,,
C,28,52.29,s,
H,29,1.67,d,7.0
H,30,1.67,d,7.0
H,31,1.67,d,7.0
H,32,5.45,q,7.0
H,33,3.82,s,
H,34,3.82,s,
H,35,3.34,ddd,"9.4,7.5,0.5"
H,36,3.34,ddd,"13.8,9.4,4.0"
H,37,2.18,ddd,"13.8,12.4,7.5"
H,38,2.18,ddd,"12.4,4.0,0.5"
H,39,7.25,ddd,"8.3,1.4,0.5"
H,40,6.94,ddd,"8.3,6.7,1.4"
H,41,7.43,ddd,"8.6,6.7,1.4"
H,42,7.32,ddd,"8.6,1.4,0.5"
H,43,2.91,s,
H,44,2.91,s,
H,45,2.91,s,
H,46,4.52,dd,"10.1,5.7"
H,47,,,
H,48,1.88,ddd,"12.4,10.1,4.0"
H,49,1.88,ddd,"12.4,5.7,3.7"
H,50,2.94,dd,"4.0,3.7"
H,51,3.97,s,
H,52,3.97,s,
H,53,,,
H,54,3.63,s,
H,55,3.63,s,
H,56,3.63,s,
