0 mol 2 unq 0 iso 0 dist 6.89072 9.5866 8.3726 11.5155 5.74846 8.798 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 6.89072 9.5866 8.3726 8.29487 4.93584 11.3341 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.35779 5.02909 8.96898 3.54604 5.83263 7.78117 numMergedOcc 0
3 mol 81 unq 0 iso 0 dist 9.53663 8.00722 8.57764 8.74391 5.2168 3.69064 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 9.40699 12.0479 8.73208 9.38171 9.06249 9.14163 numMergedOcc 0
5 mol 88 unq 1 iso 0 dist 9.40699 9.40927 5.60174 9.38171 9.06249 9.58585 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 6.12278 3.82471 8.76245 3.55467 5.53933 6.29603 numMergedOcc 0
7 mol 176 unq 0 iso 0 dist 8.51811 14.7871 9.40138 4.57491 5.60333 12.1591 numMergedOcc 0
8 mol 185 unq 0 iso 0 dist 8.07469 4.63469 9.44685 4.27185 8.22259 3.9773 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 8.25174 11.1756 9.95859 6.51839 5.24631 12.6219 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 9.16671 6.67537 9.95859 9.34381 5.24631 12.6219 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 9.49242 7.8713 6.58557 17.502 9.41473 15.1691 numMergedOcc 0
12 mol 254 unq 0 iso 0 dist 9.09568 5.53022 9.672 9.71492 6.56151 10.8023 numMergedOcc 0
13 mol 254 unq 1 iso 0 dist 9.09568 5.53022 9.672 8.60551 6.58752 12.4422 numMergedOcc 0
14 mol 254 unq 2 iso 0 dist 9.99168 5.53022 9.15233 9.71492 8.3417 10.8023 numMergedOcc 0
15 mol 254 unq 3 iso 0 dist 7.84221 9.29698 9.672 3.58476 6.56151 10.8023 numMergedOcc 0
16 mol 254 unq 4 iso 0 dist 7.84221 9.29698 9.672 7.04985 6.58752 12.4422 numMergedOcc 0
17 mol 254 unq 5 iso 0 dist 9.67383 9.29698 9.15233 3.58476 8.3417 10.8023 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 9.60767 7.45428 6.90511 8.83239 7.59138 11.4729 numMergedOcc 0
19 mol 268 unq 0 iso 0 dist 6.18877 10.5447 9.06348 4.29831 8.00345 12.6432 numMergedOcc 0
20 mol 286 unq 0 iso 0 dist 8.87916 6.87474 6.89373 6.41589 6.87255 5.74623 numMergedOcc 0
