0 mol 11 unq 0 iso 0 dist 5.87616 6.27964 7.53641 4.37231 5.7435 6.79478 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.29367 5.272 5.56136 4.87741 6.89136 7.14934 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.07937 5.272 6.58799 4.87741 10.6589 7.14934 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 5.35101 7.93406 7.63046 7.71984 6.36193 7.84983 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 5.35101 7.93406 7.63046 4.67517 4.88613 9.56737 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 9.72287 8.00221 6.64905 4.23724 10.2675 6.6003 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 9.72287 8.00221 6.64905 9.75948 10.774 6.44118 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 8.40399 8.21723 9.3324 4.98967 11.0858 8.0614 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.79412 6.98876 9.41527 4.58978 10.9561 7.88564 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 8.65822 6.98876 8.14333 4.58978 11.319 7.88564 numMergedOcc 0
10 mol 110 unq 0 iso 0 dist 8.36172 7.67702 11.3462 9.86374 13.0632 7.21229 numMergedOcc 0
11 mol 110 unq 1 iso 0 dist 8.36172 7.67702 11.3462 5.33778 9.73174 5.25492 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.65932 5.82588 6.83142 4.37081 10.0768 6.42756 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 8.78916 8.62618 3.60144 8.07956 8.79558 6.76923 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 4.43243 6.02845 6.46022 5.6375 9.48215 9.31246 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 5.92025 6.02845 5.972 5.6375 7.89744 9.31246 numMergedOcc 0
16 mol 236 unq 2 iso 0 dist 9.04819 6.02845 5.91643 5.6375 8.6417 9.31246 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.61428 5.59164 4.34203 5.77573 9.13537 6.83152 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.61428 5.59164 4.34203 4.67735 9.01016 5.24313 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 8.92585 6.86905 14.946 5.88384 13.4956 5.56719 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 6.84088 5.62744 7.04644 9.00069 13.2218 6.37342 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.62592 8.8726 3.95075 6.60345 5.73834 8.58088 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 6.98451 5.14122 4.86847 11.5005 12.7122 9.59213 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 8.74181 7.71392 14.4135 9.07177 17.6556 9.70907 numMergedOcc 0
24 mol 294 unq 1 iso 0 dist 8.74181 7.6859 14.4859 9.07177 17.6556 6.47832 numMergedOcc 0
25 mol 294 unq 2 iso 0 dist 8.96987 7.71392 15.5959 9.07177 15.9391 9.70907 numMergedOcc 0
26 mol 294 unq 3 iso 0 dist 8.96987 7.6859 11.2968 9.07177 15.9391 6.47832 numMergedOcc 0
