25 C 1.14680 1.80870 0.00080 C -0.01260 1.07580 0.00800 C -1.20900 1.78730 0.01730 S -0.63080 3.47510 0.02580 C 1.07500 3.16660 0.00830 C -2.53490 1.30010 0.02030 C -3.58280 2.17390 0.03000 C -4.95830 1.82000 0.03400 O -5.43460 0.69680 0.02870 C -5.68630 3.10080 0.04540 C -7.04020 3.43640 0.05410 C -7.41520 4.75020 0.06460 C -6.45070 5.75450 0.06660 C -5.10240 5.43610 0.05800 C -4.70520 4.10590 0.04740 O -3.48650 3.52420 0.04320 O -6.83480 7.05660 0.07750 H 2.10610 1.31280 -0.01100 H 0.00210 -0.00410 0.00200 H 1.88520 3.88070 0.00410 H -2.71920 0.23590 0.01500 H -7.79040 2.65950 0.05300 H -8.46330 5.01060 0.07170 H -4.36130 6.22170 0.05930 H -6.94160 7.42770 0.96400