C,1,51.75,s,
O,2,,,
C,3,80.53,s,
C,4,23.64,s,
C,5,45.3,s,
C,6,100.5,s,
O,7,,,
C,8,75.65,s,
C,9,43.28,s,
C,10,12.66,s,
C,11,173.45,s,
O,12,,,
O,13,,,
C,14,81.59,s,
C,15,15.0,s,
C,16,2.1,s,
C,17,2.1,s,
C,18,38.31,s,
C,19,12.71,s,
C,20,73.49,s,
O,21,,,
C,22,48.25,s,
C,23,12.15,s,
C,24,,,
O,25,,,
C,26,43.68,s,
C,27,15.6,s,
C,28,32.61,s,
C,29,32.14,s,
C,30,14.3,s,
C,31,75.29,s,
O,32,,,
C,33,102.46,s,
O,34,,,
C,35,72.7,s,
C,36,20.86,s,
C,37,36.08,s,
C,38,63.83,s,
N,39,,,
C,40,41.56,s,
C,41,41.56,s,
C,42,73.63,s,
O,43,,,
C,44,37.71,s,
C,45,12.57,s,
O,46,,,
C,47,72.56,s,
C,48,17.64,s,
C,49,74.89,s,
O,50,,,
H,51,3.31,s,
H,52,3.31,s,
H,53,3.31,s,
H,54,1.46,s,
H,55,1.46,s,
H,56,1.46,s,
H,57,2.38,dd,"12.4,1.2"
H,58,2.38,dd,"12.4,7.2"
H,59,4.95,dd,"7.2,1.2"
H,60,4.8,dd,"3.5,1.0"
H,61,2.82,qd,"6.7,3.5"
H,62,1.21,d,6.7
H,63,1.21,d,6.7
H,64,1.21,d,6.7
H,65,4.74,dd,"5.2,2.1"
H,66,0.45,m,
H,67,0.45,m,
H,68,0.45,m,
H,69,0.45,m,
H,70,0.45,m,
H,71,1.8,dqd,"7.9,6.6,2.1"
H,72,0.71,d,6.6
H,73,0.71,d,6.6
H,74,0.71,d,6.6
H,75,3.86,dd,"7.9,2.6"
H,76,,,
H,77,2.9,qd,"6.7,2.6"
H,78,1.13,d,6.7
H,79,1.13,d,6.7
H,80,1.13,d,6.7
H,81,2.78,dqd,"12.4,6.6,3.7"
H,82,1.12,d,6.6
H,83,1.12,d,6.6
H,84,1.12,d,6.6
H,85,1.66,ddd,"12.4,3.7,2.6"
H,86,1.66,td,"12.4,3.4"
H,87,2.08,m,
H,88,1.0,d,6.5
H,89,1.0,d,6.5
H,90,1.0,d,6.5
H,91,4.07,dd,"10.2,1.1"
H,92,4.28,d,3.1
H,93,4.53,ddq,"8.9,6.3,6.0"
H,94,1.29,d,6.0
H,95,1.29,d,6.0
H,96,1.29,d,6.0
H,97,2.2,ddd,"12.4,9.8,6.3"
H,98,2.2,ddd,"12.4,8.9,1.4"
H,99,3.41,ddd,"9.8,1.4,0.5"
H,100,2.84,s,
H,101,2.84,s,
H,102,2.84,s,
H,103,2.84,s,
H,104,2.84,s,
H,105,2.84,s,
H,106,3.93,dd,"3.1,0.5"
H,107,,,
H,108,2.17,dqd,"10.2,6.6,1.0"
H,109,1.08,d,6.6
H,110,1.08,d,6.6
H,111,1.08,d,6.6
H,112,3.91,qd,"6.1,1.7"
H,113,1.3,d,6.1
H,114,1.3,d,6.1
H,115,1.3,d,6.1
H,116,4.12,d,1.7
H,117,,,
