0 mol 0 unq 0 iso 0 dist 8.82102 12.7597 9.19007 10.9859 6.91778 14.0232 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.82102 10.9048 9.56794 10.9859 6.91778 10.1804 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 7.37981 6.58151 6.26831 6.63977 7.40865 5.73813 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19621 8.69991 6.26831 4.76647 7.40865 5.73813 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.90845 13.3639 6.72502 14.9821 8.60554 6.99746 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 9.90845 13.3639 6.72502 13.0288 8.44664 7.6844 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 9.90845 13.3639 6.72502 18.8056 9.44691 7.05541 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 6.48625 13.5596 8.64015 9.97686 8.08618 5.9995 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 6.67936 6.4628 5.88354 5.24592 5.59328 8.53212 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 8.25817 6.4628 5.74854 5.24592 7.5242 8.53212 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.42445 10.9798 6.34525 12.5697 6.84011 8.51024 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 9.93703 11.1498 6.98934 5.01597 8.99399 8.28905 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 9.93703 7.09096 7.99623 5.01597 8.99399 4.99495 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 9.42766 16.5854 8.56342 13.1831 6.52773 6.96805 numMergedOcc 0
14 mol 119 unq 3 iso 0 dist 9.42766 16.5854 8.56342 6.34278 9.23858 13.3975 numMergedOcc 0
15 mol 119 unq 4 iso 0 dist 9.42766 9.58167 6.37542 13.1831 6.52773 4.86811 numMergedOcc 0
16 mol 119 unq 5 iso 0 dist 9.42766 9.58167 6.37542 6.34278 9.23858 8.00229 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 8.97145 13.3078 9.29384 4.17212 8.70296 10.8127 numMergedOcc 0
18 mol 131 unq 1 iso 0 dist 8.97145 13.3078 9.29384 13.6005 9.25558 11.2516 numMergedOcc 0
19 mol 131 unq 2 iso 0 dist 6.5874 10.6416 9.29384 9.64263 8.70296 10.8127 numMergedOcc 0
20 mol 131 unq 3 iso 0 dist 6.5874 10.6416 9.29384 5.55307 9.25558 11.2516 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 9.00898 11.9192 5.4969 10.5222 9.39352 8.94702 numMergedOcc 0
22 mol 175 unq 1 iso 0 dist 9.00898 11.0956 6.4318 10.5222 9.39352 4.06277 numMergedOcc 0
23 mol 175 unq 2 iso 0 dist 9.00898 15.1521 7.35824 10.5222 9.39352 10.3786 numMergedOcc 0
24 mol 175 unq 3 iso 0 dist 9.00898 13.624 9.17364 10.5222 9.39352 11.9672 numMergedOcc 0
25 mol 188 unq 0 iso 0 dist 9.24118 11.8438 8.57261 10.9086 7.14503 5.0782 numMergedOcc 0
26 mol 188 unq 1 iso 0 dist 9.24118 11.8438 8.57261 8.98299 8.10214 5.87427 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 7.32478 14.1302 8.83356 5.35575 8.29382 12.361 numMergedOcc 0
28 mol 194 unq 1 iso 0 dist 7.32478 14.1302 8.83356 7.75447 6.72379 7.50057 numMergedOcc 0
29 mol 194 unq 2 iso 0 dist 9.48439 13.752 8.83356 7.25062 8.29382 12.361 numMergedOcc 0
30 mol 194 unq 3 iso 0 dist 9.48439 13.752 8.83356 6.38935 6.72379 7.50057 numMergedOcc 0
31 mol 198 unq 0 iso 0 dist 6.47339 10.1932 8.10985 5.47473 6.34616 9.86517 numMergedOcc 0
32 mol 210 unq 0 iso 0 dist 9.67457 13.9851 5.37446 11.6718 7.10826 7.1777 numMergedOcc 0
33 mol 222 unq 0 iso 0 dist 8.7347 11.5459 8.48341 15.9714 9.07471 7.92402 numMergedOcc 0
34 mol 227 unq 0 iso 0 dist 9.17826 7.69431 8.03442 16.3489 7.43071 12.8075 numMergedOcc 0
35 mol 227 unq 1 iso 0 dist 9.17826 7.69431 8.03442 5.75236 5.41321 4.59123 numMergedOcc 0
36 mol 234 unq 0 iso 0 dist 5.00515 10.3269 9.007 6.63685 6.30154 7.82953 numMergedOcc 0
37 mol 234 unq 1 iso 0 dist 5.00515 10.3269 9.007 10.6768 7.32499 5.76537 numMergedOcc 0
38 mol 235 unq 0 iso 0 dist 9.71281 6.09244 6.39158 6.18998 6.36341 7.85398 numMergedOcc 0
39 mol 238 unq 0 iso 0 dist 9.31417 16.0652 7.32982 16.7165 9.24557 4.77308 numMergedOcc 0
40 mol 238 unq 1 iso 0 dist 5.56719 11.468 7.32982 11.9863 9.24557 4.77308 numMergedOcc 0
41 mol 258 unq 0 iso 0 dist 5.81927 6.31492 8.15467 7.15953 7.6595 6.05037 numMergedOcc 0
42 mol 258 unq 1 iso 0 dist 6.09782 6.31492 9.1925 8.01004 9.63959 4.22544 numMergedOcc 0
43 mol 259 unq 0 iso 0 dist 7.93997 13.6686 8.55558 10.9643 7.08526 6.31909 numMergedOcc 0
44 mol 274 unq 0 iso 0 dist 9.696 16.1684 9.56685 14.679 9.85289 5.36428 numMergedOcc 0
45 mol 274 unq 1 iso 0 dist 9.696 16.3319 8.49922 14.679 9.85289 11.9754 numMergedOcc 0
