0 mol 20 unq 0 iso 0 dist 9.44151 6.81416 6.38533 5.06894 13.0023 8.25405 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.36524 8.8717 14.0576 6.65242 6.24711 9.58596 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.9651 5.94459 8.53692 4.60844 9.8703 8.05514 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.32783 6.2442 4.79817 4.4368 7.93281 6.3567 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 8.86938 5.9819 8.56707 10.5025 13.5845 5.43933 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 8.86938 5.9819 8.56707 9.50897 8.47988 4.99604 numMergedOcc 0
6 mol 112 unq 2 iso 0 dist 8.86938 5.9819 8.56707 13.6247 18.1948 9.97483 numMergedOcc 0
7 mol 112 unq 3 iso 0 dist 8.86938 5.9819 8.56707 4.9759 13.1243 7.44041 numMergedOcc 0
8 mol 112 unq 4 iso 0 dist 7.42474 5.9819 12.6695 10.5025 16.3693 5.43933 numMergedOcc 0
9 mol 112 unq 5 iso 0 dist 7.42474 5.9819 12.6695 9.50897 16.8523 4.99604 numMergedOcc 0
10 mol 112 unq 6 iso 0 dist 7.42474 5.9819 12.6695 13.6247 18.6098 9.97483 numMergedOcc 0
11 mol 112 unq 7 iso 0 dist 7.42474 5.9819 12.6695 4.9759 9.05166 7.44041 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 8.3127 7.03633 4.81686 9.31342 13.0359 9.12084 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.31276 5.8367 11.7434 4.4987 10.6728 8.48313 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 8.31276 5.8367 11.7434 4.72407 6.42772 6.99345 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 8.31276 5.8367 11.7434 7.97297 9.70973 5.11043 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 5.79157 5.8367 5.12325 4.4987 9.71716 8.48313 numMergedOcc 0
17 mol 134 unq 4 iso 0 dist 5.79157 5.8367 5.12325 4.72407 9.1998 6.99345 numMergedOcc 0
18 mol 134 unq 5 iso 0 dist 5.79157 5.8367 5.12325 7.97297 8.69531 5.11043 numMergedOcc 0
19 mol 134 unq 6 iso 0 dist 5.50687 5.8367 6.02179 4.4987 5.35237 8.48313 numMergedOcc 0
20 mol 134 unq 7 iso 0 dist 5.50687 5.8367 6.02179 4.72407 8.70621 6.99345 numMergedOcc 0
21 mol 134 unq 8 iso 0 dist 5.50687 5.8367 6.02179 7.97297 10.3432 5.11043 numMergedOcc 0
22 mol 134 unq 9 iso 0 dist 7.30919 5.8367 10.9332 4.4987 7.99477 8.48313 numMergedOcc 0
23 mol 134 unq 10 iso 0 dist 7.30919 5.8367 10.9332 4.72407 11.8779 6.99345 numMergedOcc 0
24 mol 134 unq 11 iso 0 dist 7.30919 5.8367 10.9332 7.97297 14.7874 5.11043 numMergedOcc 0
25 mol 154 unq 0 iso 0 dist 6.44195 6.03116 6.45768 13.1744 15.6983 9.82982 numMergedOcc 0
26 mol 154 unq 1 iso 0 dist 7.34207 6.03116 6.55507 13.1744 8.33439 9.82982 numMergedOcc 0
27 mol 158 unq 0 iso 0 dist 9.66837 5.32135 5.05506 6.72578 9.82249 5.48379 numMergedOcc 0
28 mol 225 unq 0 iso 0 dist 8.14464 6.06105 9.4364 5.30128 12.0438 9.57955 numMergedOcc 0
29 mol 225 unq 1 iso 0 dist 8.14464 6.06105 9.4364 7.291 15.0845 8.79277 numMergedOcc 0
30 mol 225 unq 2 iso 0 dist 9.93754 6.06105 10.6484 5.30128 6.50998 9.57955 numMergedOcc 0
31 mol 225 unq 3 iso 0 dist 9.93754 6.06105 10.6484 7.291 9.09424 8.79277 numMergedOcc 0
32 mol 236 unq 0 iso 0 dist 8.95071 9.33359 7.00028 4.51728 10.0129 9.14068 numMergedOcc 0
33 mol 252 unq 0 iso 0 dist 6.17985 8.62351 5.89666 7.51673 10.6424 8.19529 numMergedOcc 0
34 mol 252 unq 1 iso 0 dist 6.17985 8.62351 5.89666 9.93939 11.0129 6.45396 numMergedOcc 0
35 mol 264 unq 0 iso 0 dist 9.07206 9.91954 12.6928 10.6477 16.2887 6.02757 numMergedOcc 0
36 mol 264 unq 1 iso 0 dist 9.07206 9.91954 12.6928 10.998 15.3072 8.67231 numMergedOcc 0
37 mol 284 unq 0 iso 0 dist 9.98268 8.79958 11.8906 16.3287 15.415 9.07503 numMergedOcc 0
38 mol 284 unq 1 iso 0 dist 9.98268 8.79958 11.8906 15.4224 17.3359 7.63256 numMergedOcc 0
39 mol 284 unq 2 iso 0 dist 6.83147 8.79958 6.4399 16.3287 12.5394 9.07503 numMergedOcc 0
40 mol 284 unq 3 iso 0 dist 6.83147 8.79958 6.4399 15.4224 13.1224 7.63256 numMergedOcc 0
41 mol 284 unq 4 iso 0 dist 7.43241 8.79958 13.016 16.3287 21.2531 9.07503 numMergedOcc 0
42 mol 284 unq 5 iso 0 dist 7.43241 8.79958 13.016 15.4224 18.8246 7.63256 numMergedOcc 0
