0 mol 13 unq 0 iso 0 dist 9.11704 7.84471 6.52528 11.2512 5.30861 9.21911 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.05123 7.89733 8.83891 10.8743 7.49229 6.23015 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 5.36278 5.3571 9.78134 8.9204 7.29489 9.41017 numMergedOcc 0
3 mol 29 unq 1 iso 0 dist 7.50258 12.1835 9.78134 14.3504 7.29489 9.41017 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.90896 11.5216 9.79061 6.66506 5.00474 6.14542 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 4.34694 4.93697 7.47162 6.82707 10.5011 8.4701 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.7142 13.0959 9.73179 15.0165 7.75939 7.46095 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 8.61089 7.19348 8.26763 15.1365 9.40625 9.77084 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 8.61089 9.62824 6.30814 15.1365 9.40625 6.5551 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 8.64686 11.5374 8.26763 9.21479 9.40625 9.77084 numMergedOcc 0
10 mol 79 unq 3 iso 0 dist 8.64686 5.21981 6.30814 9.21479 9.40625 6.5551 numMergedOcc 0
11 mol 91 unq 0 iso 0 dist 8.91354 5.09341 9.84288 6.93893 5.06999 8.77355 numMergedOcc 0
12 mol 159 unq 0 iso 0 dist 9.9368 15.7186 9.45909 24.8356 17.2892 9.35202 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 8.10386 11.6479 9.66676 10.3411 4.11212 6.47164 numMergedOcc 0
14 mol 170 unq 1 iso 0 dist 8.10386 11.6479 9.66676 16.41 9.2613 9.65126 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 7.2833 4.79025 9.20541 9.25935 8.71774 6.22742 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 7.2833 6.01032 6.65077 13.1745 7.07871 9.24936 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 9.87574 8.69902 9.40433 16.0805 11.7342 8.63279 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 8.05949 10.8542 7.80421 17.1665 10.4519 9.68477 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 8.8113 6.97024 7.71863 11.2825 9.64482 7.30592 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 8.8113 6.97024 7.71863 8.99978 4.86001 9.46687 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 8.48545 3.28983 9.993 6.91534 9.08479 8.95511 numMergedOcc 0
22 mol 239 unq 1 iso 0 dist 8.48545 3.28983 9.993 9.05892 15.0274 5.85002 numMergedOcc 0
23 mol 244 unq 0 iso 0 dist 7.79787 8.65358 8.93589 9.97458 4.89551 6.53416 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 8.03486 4.91802 8.34313 9.29922 15.4124 7.17958 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 5.83342 7.60595 9.63325 13.9961 12.0583 8.62162 numMergedOcc 0
