0 mol 34 unq 0 iso 0 dist 8.36524 6.20159 13.7039 6.87212 14.0782 6.44363 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.84521 8.07389 8.42544 14.9559 13.3732 9.52295 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 8.07389 6.09486 14.9559 8.38387 9.52295 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 6.78532 8.07389 4.40385 14.9559 12.9363 9.52295 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.9795 7.82214 5.46695 12.1057 9.89682 9.27456 numMergedOcc 0
5 mol 110 unq 0 iso 0 dist 8.60857 5.52502 3.99091 6.89612 8.181 4.78944 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 6.44195 5.7306 4.66975 13.0181 12.4833 9.19804 numMergedOcc 0
7 mol 154 unq 1 iso 0 dist 7.34207 5.7306 9.20471 13.0181 17.9801 9.19804 numMergedOcc 0
8 mol 167 unq 0 iso 0 dist 7.9895 7.71402 7.45933 4.88159 10.5599 6.00793 numMergedOcc 0
9 mol 167 unq 1 iso 0 dist 6.53913 7.71402 6.38496 4.88159 5.59806 6.00793 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.0639 9.02321 5.04574 4.40927 7.80299 9.21553 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 6.91355 9.02321 11.8536 4.40927 10.1863 9.21553 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 9.25882 6.254 6.16939 5.82036 13.921 9.67328 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 5.82039 9.1579 6.13816 8.60571 9.78438 6.38964 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 6.22964 9.1579 9.20417 8.60571 10.1863 6.38964 numMergedOcc 0
15 mol 237 unq 0 iso 0 dist 7.77366 9.81108 7.33449 7.63505 11.0518 7.11512 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 9.2067 9.95473 8.40328 5.17102 11.4077 8.4485 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 9.16078 9.95473 10.2114 5.17102 12.7091 8.4485 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 6.95233 9.85095 5.60582 17.2861 15.082 9.58747 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 9.61741 9.85095 17.1864 17.2861 24.5294 9.58747 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 5.61056 9.85095 12.5903 17.2861 21.3504 9.58747 numMergedOcc 0
