C,1,51.81,s,
O,2,,,
C,3,169.39,s,
O,4,,,
C,5,145.75,s,
C,6,20.45,s,
C,7,120.68,s,
C,8,166.9,s,
O,9,,,
O,10,,,
C,11,66.89,s,
C,12,32.2,s,
C,13,59.6,s,
C,14,79.1,s,
O,15,,,
C,16,166.9,s,
O,17,,,
C,18,115.89,s,
C,19,158.42,s,
C,20,23.5,s,
C,21,23.5,s,
C,22,36.4,s,
C,23,65.5,s,
C,24,33.7,s,
N,25,,,
C,26,39.2,s,
H,27,3.72,s,
H,28,3.72,s,
H,29,3.72,s,
H,30,2.06,s,
H,31,2.06,s,
H,32,2.06,s,
H,33,5.87,s,
H,34,5.16,m,
H,35,2.18,ddd,"12.4,11.2,1.5"
H,36,2.18,ddd,"12.4,8.8,5.6"
H,37,3.35,ddd,"8.8,1.5,0.4"
H,38,5.85,ddd,"9.9,5.3,0.4"
H,39,5.66,s,
H,40,2.06,s,
H,41,2.06,s,
H,42,2.06,s,
H,43,2.06,s,
H,44,2.06,s,
H,45,2.06,s,
H,46,2.39,ddd,"12.4,9.9,1.0"
H,47,2.39,ddd,"12.4,6.6,5.3"
H,48,3.38,m,
H,49,2.25,ddd,"12.4,10.7,1.3"
H,50,2.25,ddd,"12.4,9.4,6.2"
H,51,2.59,s,
H,52,2.59,s,
H,53,2.59,s,
