C,1,12.97,s,
C,2,121.02,s,
C,3,146.35,s,
C,4,52.94,s,
N,5,,,
C,6,51.91,s,
C,7,38.94,s,
C,8,41.86,s,
C,9,134.28,s,
C,10,127.72,s,
C,11,128.32,s,
C,12,156.64,s,
C,13,93.1,s,
C,14,142.35,s,
N,15,,,
C,16,35.85,s,
C,17,57.53,s,
C,18,56.75,s,
C,19,35.12,s,
C,20,31.9,s,
C,21,51.6,s,
C,22,171.4,s,
O,23,,,
O,24,,,
C,25,51.9,s,
O,26,,,
C,27,102.94,s,
O,28,,,
C,29,70.43,s,
C,30,38.77,s,
C,31,62.1,s,
C,32,27.4,s,
C,33,108.8,s,
C,34,133.78,s,
N,35,,,
C,36,30.73,s,
C,37,136.35,s,
C,38,111.99,s,
C,39,113.55,s,
C,40,156.11,s,
O,41,,,
C,42,55.62,s,
C,43,101.31,s,
C,44,130.47,s,
C,45,57.96,s,
C,46,36.24,s,
C,47,37.64,s,
C,48,46.13,s,
C,49,38.23,s,
C,50,19.23,s,
N,51,,,
C,52,36.91,s,
H,53,1.65,d,7.0
H,54,1.65,d,7.0
H,55,1.65,d,7.0
H,56,5.49,q,7.0
H,57,3.31,s,
H,58,3.31,s,
H,59,2.64,ddd,"12.4,9.8,1.7"
H,60,2.64,ddd,"12.4,9.3,8.1"
H,61,2.18,ddd,"12.4,9.3,1.7"
H,62,2.18,ddd,"12.4,9.8,8.1"
H,63,7.2,d,0.5
H,64,7.09,d,0.5
H,65,3.18,s,
H,66,3.18,s,
H,67,3.18,s,
H,68,4.28,d,2.8
H,69,2.3,ddd,"3.9,2.8,1.6"
H,70,2.05,ddd,"12.4,5.3,1.6"
H,71,2.05,ddd,"12.4,3.9,2.8"
H,72,3.69,ddd,"5.3,2.8,1.6"
H,73,3.08,d,1.6
H,74,3.7,s,
H,75,3.7,s,
H,76,3.7,s,
H,77,5.23,d,6.7
H,78,4.04,dd,"10.6,9.4"
H,79,4.04,dd,"9.4,7.7"
H,80,2.27,m,
H,81,3.6,ddd,"10.1,4.5,1.1"
H,82,3.21,dd,"15.4,1.1"
H,83,3.21,dd,"15.4,10.1"
H,84,3.38,s,
H,85,3.38,s,
H,86,3.38,s,
H,87,7.55,dd,"8.3,0.5"
H,88,6.82,dd,"8.3,1.9"
H,89,3.84,s,
H,90,3.84,s,
H,91,3.84,s,
H,92,6.95,dd,"1.9,0.5"
H,93,5.19,dd,"8.2,1.2"
H,94,1.87,ddd,"12.4,8.3,1.2"
H,95,1.87,ddd,"12.4,9.4,8.2"
H,96,1.55,m,
H,97,2.1,ddd,"10.4,7.4,6.7"
H,98,3.1,dq,"7.4,6.7"
H,99,1.24,d,6.7
H,100,1.24,d,6.7
H,101,1.24,d,6.7
H,102,2.52,s,
H,103,2.52,s,
H,104,2.52,s,
