C,1,112.49,s,
C,2,145.56,s,
C,3,41.86,s,
C,4,62.58,s,
N,5,,,
C,6,42.3,s,
C,7,63.5,s,
C,8,38.77,s,
C,9,63.9,s,
O,10,,,
C,11,78.41,s,
C,12,35.12,s,
C,13,50.54,s,
C,14,41.86,s,
C,15,172.27,s,
O,16,,,
N,17,,,
O,18,,,
C,19,63.6,s,
C,20,138.3,s,
C,21,107.2,s,
C,22,128.1,s,
C,23,122.44,s,
C,24,124.58,s,
C,25,134.28,s,
C,26,40.4,s,
H,27,4.9,dd,"16.0,2.5"
H,28,4.9,dd,"12.0,2.5"
H,29,5.85,dd,"16.0,12.0"
H,30,3.17,s,
H,31,3.17,s,
H,32,2.35,s,
H,33,2.35,s,
H,34,2.35,s,
H,35,4.28,d,3.0
H,36,2.27,ddd,"9.6,3.4,3.1"
H,37,4.04,dd,"9.4,3.4"
H,38,4.04,dd,"9.4,3.1"
H,39,4.77,dd,"4.3,1.6"
H,40,1.88,ddd,"12.4,4.5,1.6"
H,41,1.88,ddd,"12.4,4.3,1.2"
H,42,1.61,ddd,"9.6,4.5,1.2"
H,43,3.73,s,
H,44,3.73,s,
H,45,3.73,s,
H,46,7.14,ddd,"7.6,1.4,0.5"
H,47,7.23,ddd,"7.7,7.6,1.4"
H,48,6.94,ddd,"9.5,7.7,1.4"
H,49,7.25,ddd,"9.5,1.4,0.5"
H,50,2.83,d,3.0
