C,1,38.78,s,
N,2,,,
C,3,145.18,s,
C,4,116.5,s,
C,5,135.2,s,
C,6,122.52,s,
C,7,126.88,s,
C,8,122.2,s,
C,9,182.23,s,
O,10,,,
C,11,107.27,s,
C,12,166.8,s,
O,13,,,
C,14,93.17,s,
C,15,168.67,s,
C,16,102.6,s,
C,17,143.73,s,
C,18,33.73,s,
C,19,83.52,s,
C,20,77.48,s,
C,21,25.81,s,
O,22,,,
C,23,51.45,s,
Cl,24,,,
O,25,,,
H,26,4.07,s,
H,27,4.07,s,
H,28,4.07,s,
H,29,7.65,ddd,"9.1,1.4,0.5"
H,30,7.79,ddd,"9.1,6.3,1.4"
H,31,7.28,ddd,"7.4,6.3,1.4"
H,32,8.31,ddd,"7.4,1.4,0.5"
H,33,,,
H,34,6.16,s,
H,35,3.85,dd,"12.4,6.3"
H,36,3.85,dd,"12.4,11.8"
H,37,4.54,dd,"11.8,6.3"
H,38,1.4,s,
H,39,1.4,s,
H,40,1.4,s,
H,41,,,
H,42,3.27,s,
H,43,3.27,s,
