C,1,56.02,s,
O,2,,,
C,3,150.42,s,
C,4,111.07,s,
C,5,127.92,s,
C,6,136.19,s,
C,7,125.15,s,
C,8,145.43,s,
O,9,,,
C,10,60.98,s,
C,11,57.53,s,
C,12,95.84,s,
Cl,13,,,
Cl,14,,,
Cl,15,,,
N,16,,,
C,17,49.76,s,
C,18,30.03,s,
C,19,131.87,s,
C,20,110.47,s,
C,21,147.78,s,
C,22,147.29,s,
C,23,110.34,s,
C,24,128.65,s,
C,25,146.97,s,
C,26,117.49,s,
O,27,,,
C,28,101.24,s,
O,29,,,
H,30,3.87,s,
H,31,3.87,s,
H,32,3.87,s,
H,33,6.68,d,7.7
H,34,6.75,d,7.7
H,35,3.84,s,
H,36,3.84,s,
H,37,3.84,s,
H,38,4.28,s,
H,39,3.34,ddd,"12.4,12.0,6.3"
H,40,3.34,ddd,"12.4,5.1,1.7"
H,41,2.82,ddd,"15.4,12.0,5.1"
H,42,2.82,ddd,"15.4,6.3,1.7"
H,43,6.68,d,0.5
H,44,6.94,d,0.5
H,45,7.07,s,
H,46,6.12,s,
H,47,6.12,s,
