C,1,53.1,s,
O,2,,,
C,3,153.4,s,
O,4,,,
N,5,,,
C,6,142.35,s,
C,7,116.11,s,
C,8,131.17,s,
C,9,122.44,s,
C,10,124.58,s,
C,11,134.28,s,
C,12,41.86,s,
C,13,49.84,s,
C,14,,,
O,15,,,
C,16,49.84,s,
C,17,36.6,s,
C,18,34.4,s,
C,19,20.97,s,
C,20,49.76,s,
N,21,,,
C,22,161.74,s,
O,23,,,
C,24,71.28,s,
C,25,35.7,s,
C,26,23.3,s,
C,27,77.8,s,
C,28,171.5,s,
O,29,,,
O,30,,,
C,31,52.5,s,
H,32,3.74,s,
H,33,3.74,s,
H,34,3.74,s,
H,35,7.32,ddd,"8.9,1.4,0.5"
H,36,7.43,ddd,"8.9,7.0,1.4"
H,37,6.94,ddd,"7.6,7.0,1.4"
H,38,7.25,ddd,"7.6,1.4,0.5"
H,39,2.57,s,
H,40,2.57,s,
H,41,2.57,s,
H,42,2.57,s,
H,43,1.72,ddd,"12.4,9.9,8.9"
H,44,1.72,ddd,"12.4,8.8,1.4"
H,45,1.61,m,
H,46,1.61,m,
H,47,3.66,ddd,"12.4,11.0,7.6"
H,48,3.66,ddd,"12.4,10.7,1.4"
H,49,8.25,s,
H,50,2.67,s,
H,51,1.72,ddd,"12.4,9.3,1.6"
H,52,1.72,ddd,"12.4,10.3,9.0"
H,53,1.99,ddd,"12.4,9.0,1.6"
H,54,1.99,ddd,"12.4,10.3,9.3"
H,55,3.6,s,
H,56,3.6,s,
H,57,3.6,s,
