0 mol 11 unq 0 iso 0 dist 9.07476 6.65725 4.79838 14.3284 10.7048 9.53002 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.81085 5.88467 7.84204 14.6855 12.8511 8.82012 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.81085 5.88467 7.84204 10.2329 15.962 9.16962 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 4.90216 4.07863 7.92479 9.59244 11.6713 6.23899 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 9.84217 4.07863 7.86646 9.59244 3.88148 6.23899 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.4515 15.9672 7.78587 11.3877 4.73407 8.70133 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.4515 15.9672 7.78587 10.7935 3.85805 5.64598 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.4515 15.9672 7.78587 13.2659 5.17781 4.65521 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 6.46582 13.2281 8.90522 6.4551 3.69293 9.49449 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 8.48827 10.1263 7.03887 11.3374 8.82915 8.30646 numMergedOcc 0
10 mol 78 unq 1 iso 0 dist 8.03895 6.88255 7.03887 9.31978 8.82915 8.30646 numMergedOcc 0
11 mol 78 unq 2 iso 0 dist 7.14048 10.1263 5.36451 11.3374 6.33118 8.30646 numMergedOcc 0
12 mol 78 unq 3 iso 0 dist 5.68873 6.88255 5.36451 9.31978 6.33118 8.30646 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 6.10053 4.97513 6.18681 5.9179 4.79453 8.39016 numMergedOcc 0
14 mol 90 unq 1 iso 0 dist 6.10053 4.97513 6.18681 9.34782 6.34112 6.99355 numMergedOcc 0
15 mol 101 unq 0 iso 0 dist 6.67863 9.59696 8.35515 9.96707 10.1773 9.57816 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 7.26558 4.20839 9.67312 7.30954 6.40668 8.61331 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.17301 4.48609 7.61421 10.6635 11.618 6.71012 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 9.67243 6.17401 8.49913 7.70279 4.14873 7.07392 numMergedOcc 0
19 mol 232 unq 1 iso 0 dist 9.67243 6.17401 8.49913 12.1893 6.71567 9.62952 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 8.1174 5.52698 9.11149 8.48065 4.75609 8.21247 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 6.69951 7.53102 5.23503 6.42725 5.97386 6.77938 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 6.69951 6.58569 9.61028 6.42725 5.97386 7.76676 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 5.8898 5.55314 8.03604 9.772 7.71667 6.34034 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 9.82713 5.95459 9.85661 6.55855 4.60007 9.19234 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 8.72101 13.2782 9.62597 14.3441 7.75371 9.41725 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 5.11998 13.8592 9.62597 9.29635 7.75371 9.41725 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 9.64969 10.3713 9.33755 17.3133 15.321 7.34205 numMergedOcc 0
