0 mol 8 unq 0 iso 0 dist 8.76702 8.23769 8.80082 5.95206 12.2148 6.26865 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.27477 8.23769 11.0277 5.95206 10.3197 6.26865 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 8.28463 7.90154 10.1814 3.71754 9.77484 8.11206 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 7.04193 5.99959 9.95096 12.9126 18.0433 8.80108 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 7.04193 5.99959 9.95096 10.3955 15.8232 6.50297 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 7.15486 5.99959 5.11205 12.9126 13.7148 8.80108 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 7.15486 5.99959 5.11205 10.3955 9.89984 6.50297 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 8.52969 5.99959 6.75888 12.9126 8.26899 8.80108 numMergedOcc 0
8 mol 58 unq 5 iso 0 dist 8.52969 5.99959 6.75888 10.3955 11.3177 6.50297 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 8.93949 8.81795 4.65281 7.11982 11.3203 8.06829 numMergedOcc 0
10 mol 99 unq 0 iso 0 dist 9.24442 8.13381 5.81128 5.03719 7.72108 6.6925 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 4.93035 9.82638 7.57216 15.7898 15.487 8.55681 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 4.93035 9.82638 7.57216 6.70767 6.93652 6.2135 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 9.75558 9.82638 12.6352 15.7898 20.9445 8.55681 numMergedOcc 0
14 mol 141 unq 3 iso 0 dist 9.75558 9.82638 12.6352 6.70767 11.8898 6.2135 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 7.39961 9.89595 9.30783 5.58352 8.47155 6.90155 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 7.80643 9.89595 7.29758 5.58352 9.36805 6.90155 numMergedOcc 0
17 mol 187 unq 0 iso 0 dist 7.68247 9.25461 6.62321 4.8403 9.27478 7.01496 numMergedOcc 0
18 mol 213 unq 0 iso 0 dist 9.40939 7.67499 11.2214 6.32328 14.581 8.74171 numMergedOcc 0
19 mol 213 unq 1 iso 0 dist 9.40939 7.67499 11.2214 7.32166 15.0563 6.85195 numMergedOcc 0
20 mol 213 unq 2 iso 0 dist 9.06306 7.67499 11.1059 6.32328 8.45368 8.74171 numMergedOcc 0
21 mol 213 unq 3 iso 0 dist 9.06306 7.67499 11.1059 7.32166 14.1277 6.85195 numMergedOcc 0
22 mol 213 unq 4 iso 0 dist 8.10356 6.91442 7.28105 9.7466 11.9811 6.85195 numMergedOcc 0
23 mol 213 unq 5 iso 0 dist 8.10356 6.91442 7.28105 5.52154 10.7798 6.17451 numMergedOcc 0
24 mol 213 unq 6 iso 0 dist 6.77104 6.91442 4.93472 9.7466 6.68292 6.85195 numMergedOcc 0
25 mol 213 unq 7 iso 0 dist 6.77104 6.91442 4.93472 5.52154 4.26212 6.17451 numMergedOcc 0
26 mol 213 unq 8 iso 0 dist 4.71403 9.02942 7.28105 11.5806 11.9811 6.85195 numMergedOcc 0
27 mol 213 unq 9 iso 0 dist 4.71403 9.02942 7.28105 9.51526 10.7798 6.17451 numMergedOcc 0
28 mol 218 unq 0 iso 0 dist 5.52981 8.39955 4.54272 6.48676 7.17547 8.57853 numMergedOcc 0
29 mol 218 unq 1 iso 0 dist 6.22077 8.39955 6.8949 6.48676 7.13323 8.57853 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 9.82174 8.97261 12.5773 11.0807 17.4568 6.65088 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 7.2527 5.3853 5.11565 6.74192 10.924 6.00721 numMergedOcc 0
32 mol 238 unq 2 iso 0 dist 7.13194 5.3853 11.0401 6.74192 13.368 6.00721 numMergedOcc 0
33 mol 238 unq 3 iso 0 dist 9.2521 8.97261 11.2717 11.0807 9.38422 6.65088 numMergedOcc 0
34 mol 238 unq 4 iso 0 dist 9.41975 9.14992 5.49433 9.67414 12.8291 9.0378 numMergedOcc 0
35 mol 238 unq 5 iso 0 dist 8.51359 8.97261 14.7509 11.0807 12.8291 6.65088 numMergedOcc 0
36 mol 250 unq 0 iso 0 dist 6.18342 8.4419 7.26274 6.92778 11.0437 8.16469 numMergedOcc 0
37 mol 250 unq 1 iso 0 dist 6.18342 8.4419 7.26274 6.49019 8.80086 9.88279 numMergedOcc 0
38 mol 282 unq 0 iso 0 dist 6.65024 8.47112 5.9438 6.25775 9.58517 6.73692 numMergedOcc 0
39 mol 294 unq 0 iso 0 dist 7.1984 5.29065 6.46298 6.28374 9.03492 7.72845 numMergedOcc 0
