0 mol 2 unq 0 iso 0 dist 7.87526 7.60935 5.72209 6.99962 9.49977 9.78005 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 6.69539 8.35273 4.0384 5.5951 5.61893 4.64234 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.75432 5.23167 3.70802 8.02816 10.7642 7.25138 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 8.45469 5.23167 3.66673 8.02816 9.3024 7.25138 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 6.80165 7.94697 5.53904 11.2863 9.89076 9.53663 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 8.23533 5.52904 4.66066 5.41685 9.29411 6.10053 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.95777 7.91691 9.06356 3.97596 9.42444 8.60172 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 8.44588 9.27028 3.7042 16.1275 8.28452 7.08403 numMergedOcc 0
8 mol 113 unq 1 iso 0 dist 9.16474 6.38269 9.30891 12.0115 15.213 7.96893 numMergedOcc 0
9 mol 120 unq 0 iso 0 dist 8.99783 6.84006 5.90666 3.55317 9.31927 9.18784 numMergedOcc 0
10 mol 120 unq 1 iso 0 dist 7.30776 9.08322 5.90666 4.53716 9.31927 9.18784 numMergedOcc 0
11 mol 120 unq 2 iso 0 dist 8.82602 8.02114 5.90666 6.10284 9.31927 9.18784 numMergedOcc 0
12 mol 136 unq 0 iso 0 dist 5.95839 6.99374 7.8989 4.90618 10.2782 8.59512 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 9.28392 6.18165 13.6106 9.58263 18.2032 7.78577 numMergedOcc 0
14 mol 253 unq 0 iso 0 dist 8.18538 8.34984 9.06758 7.48068 7.02076 8.71119 numMergedOcc 0
15 mol 281 unq 0 iso 0 dist 9.79394 8.78416 3.86368 6.85714 10.0436 6.82918 numMergedOcc 0
16 mol 281 unq 1 iso 0 dist 9.79394 9.22428 7.4282 16.6962 15.692 9.13909 numMergedOcc 0
17 mol 281 unq 2 iso 0 dist 9.79394 9.22428 7.4282 6.85714 10.0436 4.29351 numMergedOcc 0
18 mol 281 unq 3 iso 0 dist 6.52115 7.82358 3.86368 12.3603 10.0436 6.82918 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 9.25959 5.64165 5.79571 4.30784 12.5462 8.19757 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 8.62338 7.96707 3.76412 9.99556 12.3269 8.71974 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 8.62338 7.96707 3.76412 7.99722 8.19213 8.82649 numMergedOcc 0
22 mol 287 unq 2 iso 0 dist 8.62338 7.96707 3.76412 12.9629 5.80664 7.35776 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 8.62338 7.96707 3.76412 9.99556 12.3269 8.71974 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 8.62338 7.96707 3.76412 7.99722 8.19213 8.82649 numMergedOcc 0
25 mol 288 unq 2 iso 0 dist 8.62338 7.96707 3.76412 12.9629 5.80664 7.35776 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.62338 7.96707 3.76412 9.99556 12.3269 8.71974 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 8.62338 7.96707 3.76412 7.99722 8.19213 8.82649 numMergedOcc 0
28 mol 289 unq 2 iso 0 dist 8.62338 7.96707 3.76412 12.9629 5.80664 7.35776 numMergedOcc 0
29 mol 294 unq 0 iso 0 dist 9.03579 9.14005 13.7631 8.68297 17.5317 9.64969 numMergedOcc 0
