C,1,113.66,s,
C,2,143.93,s,
C,3,41.72,s,
C,4,23.34,s,
C,5,23.34,s,
C,6,41.86,s,
C,7,42.83,s,
C,8,69.05,s,
O,9,,,
C,10,171.19,s,
O,11,,,
N,12,,,
C,13,137.88,s,
C,14,100.28,s,
C,15,143.53,s,
C,16,122.1,s,
N,17,,,
C,18,137.1,s,
N,19,,,
C,20,159.19,s,
O,21,,,
N,22,,,
C,23,,,
N,24,,,
O,25,,,
C,26,62.25,s,
C,27,139.75,s,
C,28,114.42,s,
C,29,128.15,s,
C,30,122.44,s,
C,31,124.58,s,
C,32,134.28,s,
H,33,5.16,dd,"12.0,2.5"
H,34,5.16,dd,"16.0,2.5"
H,35,5.97,dd,"16.0,12.0"
H,36,1.1,s,
H,37,1.1,s,
H,38,1.1,s,
H,39,1.1,s,
H,40,1.1,s,
H,41,1.1,s,
H,42,2.1,dd,"12.4,2.7"
H,43,2.1,dd,"12.4,5.2"
H,44,4.06,dd,"5.2,2.7"
H,45,,,
H,46,7.43,s,
H,47,6.99,s,
H,48,,,
H,49,8.2,s,
H,50,7.97,s,
H,51,3.73,s,
H,52,3.73,s,
H,53,3.73,s,
H,54,7.14,ddd,"6.5,1.4,0.5"
H,55,7.23,ddd,"8.6,6.5,1.4"
H,56,6.94,td,"8.6,1.4"
H,57,7.25,ddd,"8.6,1.4,0.5"
