C,1,11.09,s,
C,2,24.8,s,
C,3,30.26,s,
C,4,14.93,s,
C,5,57.04,s,
C,6,169.5,s,
O,7,,,
N,8,,,
C,9,47.08,s,
C,10,24.9,s,
C,11,28.9,s,
C,12,59.04,s,
C,13,170.15,s,
O,14,,,
O,15,,,
C,16,77.06,s,
C,17,33.5,s,
C,18,19.48,s,
C,19,19.48,s,
C,20,35.12,s,
C,21,31.42,s,
C,22,21.01,s,
C,23,35.12,s,
C,24,71.11,s,
O,25,,,
C,26,40.4,s,
C,27,18.87,s,
C,28,171.55,s,
N,29,,,
C,30,76.75,s,
C,31,133.7,s,
C,32,132.07,s,
C,33,18.56,s,
C,34,164.9,s,
O,35,,,
N,36,,,
C,37,57.53,s,
C,38,32.8,s,
C,39,134.98,s,
C,40,129.14,s,
C,41,113.66,s,
C,42,158.07,s,
O,43,,,
C,44,55.32,s,
C,45,113.66,s,
C,46,129.14,s,
C,47,169.5,s,
O,48,,,
N,49,,,
C,50,27.2,s,
C,51,53.83,s,
C,52,18.06,s,
C,53,169.5,s,
O,54,,,
N,55,,,
C,56,30.17,s,
C,57,40.15,s,
S,58,,,
H,59,0.9,t,7.0
H,60,0.9,t,7.0
H,61,0.9,t,7.0
H,62,1.37,qd,"7.0,6.0"
H,63,1.37,qd,"7.0,6.0"
H,64,2.15,qtd,"6.5,6.0,5.7"
H,65,0.86,d,6.5
H,66,0.86,d,6.5
H,67,0.86,d,6.5
H,68,5.19,d,5.7
H,69,3.67,ddd,"12.4,10.9,9.0"
H,70,3.67,ddd,"12.4,10.5,1.9"
H,71,1.45,m,
H,72,1.45,m,
H,73,1.91,m,
H,74,1.91,m,
H,75,4.65,dd,"7.9,0.6"
H,76,4.88,ddd,"7.3,5.0,2.1"
H,77,1.77,m,"6.4,5.0"
H,78,0.84,d,6.4
H,79,0.84,d,6.4
H,80,0.84,d,6.4
H,81,0.84,d,6.4
H,82,0.84,d,6.4
H,83,0.84,d,6.4
H,84,1.88,ddd,"12.4,3.4,2.1"
H,85,1.88,ddd,"12.4,7.3,4.4"
H,86,1.58,m,
H,87,0.89,d,6.4
H,88,0.89,d,6.4
H,89,0.89,d,6.4
H,90,1.88,ddd,"12.4,1.9,0.8"
H,91,1.88,ddd,"12.4,11.1,10.2"
H,92,4.19,ddd,"11.1,1.3,0.8"
H,93,,,
H,94,2.83,qd,"6.8,1.3"
H,95,1.03,d,6.8
H,96,1.03,d,6.8
H,97,1.03,d,6.8
H,98,4.28,ddd,"10.5,5.7,4.8"
H,99,5.73,d,4.8
H,100,1.92,s,
H,101,1.92,s,
H,102,1.92,s,
H,103,,,
H,104,3.58,t,6.2
H,105,3.5,d,6.2
H,106,3.5,d,6.2
H,107,7.22,ddd,"8.5,1.9,0.5"
H,108,6.8,ddd,"8.5,1.9,0.5"
H,109,3.76,s,
H,110,3.76,s,
H,111,3.76,s,
H,112,6.8,ddd,"8.9,1.9,0.5"
H,113,7.22,ddd,"8.9,1.9,0.5"
H,114,2.91,s,
H,115,2.91,s,
H,116,2.91,s,
H,117,3.73,q,6.8
H,118,1.4,d,6.8
H,119,1.4,d,6.8
H,120,1.4,d,6.8
H,121,2.99,s,
H,122,2.99,s,
H,123,2.99,s,
H,124,3.23,dd,"12.4,10.5"
H,125,3.23,dd,"12.4,5.7"
