C,1,56.11,s,
O,2,,,
C,3,153.95,s,
C,4,106.82,s,
C,5,38.16,s,
C,6,41.86,s,
C,7,196.9,s,
O,8,,,
C,9,71.43,s,
Cl,10,,,
C,11,47.9,s,
C,12,73.8,s,
N,13,,,
C,14,44.6,s,
C,15,28.5,s,
C,16,53.4,s,
C,17,45.4,s,
C,18,192.2,s,
O,19,,,
C,20,136.6,s,
O,21,,,
C,22,60.3,s,
C,23,163.3,s,
O,24,,,
C,25,60.9,s,
H,26,3.87,s,
H,27,3.87,s,
H,28,3.87,s,
H,29,5.89,dd,"4.9,2.7"
H,30,2.22,dd,"12.4,4.9"
H,31,2.22,dd,"12.4,2.7"
H,32,4.51,dd,"7.8,1.2"
H,33,2.05,dd,"12.4,1.2"
H,34,2.05,dd,"12.4,7.8"
H,35,,,
H,36,3.11,ddd,"11.3,9.4,3.4"
H,37,3.11,ddd,"11.3,9.4,6.1"
H,38,2.18,ddd,"12.4,11.3,3.4"
H,39,2.18,ddd,"12.4,11.3,6.1"
H,40,2.57,s,
H,41,2.57,s,
H,42,3.81,s,
H,43,3.81,s,
H,44,3.81,s,
H,45,3.74,s,
H,46,3.74,s,
H,47,3.74,s,
