0 mol 10 unq 0 iso 0 dist 6.20404 4.62965 8.93461 11.1683 11.0871 9.78153 19.4762 18.1516 17.1926 8.99402 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 9.04935 4.82573 5.55798 13.2324 6.05149 8.64686 13.9849 8.71103 9.57704 7.41952 numMergedOcc 0
2 mol 99 unq 0 iso 0 dist 7.28774 6.04335 5.61946 12.4775 6.02095 8.68674 7.05715 5.33644 4.74328 6.81741 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 9.64736 3.9634 8.23356 8.10965 5.86578 6.56481 4.76694 11.9113 5.73608 7.81042 numMergedOcc 0
4 mol 132 unq 0 iso 0 dist 7.64207 4.8602 8.72039 5.52837 7.53392 9.39389 9.98904 12.8674 10.8474 8.15549 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.86691 8.09812 6.9268 13.4646 8.75242 5.79195 5.48547 6.85651 5.35551 9.07294 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 9.86691 8.09812 6.9268 8.72732 14.0828 9.2759 10.5918 16.9398 10.8516 5.12189 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 9.86691 8.09812 6.9268 8.72732 14.0828 9.2759 5.48547 6.85651 5.35551 7.50126 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 6.28769 5.30543 5.47265 10.2396 7.75436 5.32865 3.87868 8.52428 4.61905 9.13646 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 9.38623 4.91302 6.28957 7.04009 5.44954 7.20545 6.20034 12.7444 9.97915 9.82329 numMergedOcc 0
10 mol 217 unq 0 iso 0 dist 9.51059 5.1774 7.80898 8.29482 4.10975 7.60302 4.89824 8.79299 5.16489 6.01666 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 6.17825 8.7629 9.03261 11.5161 9.96567 8.74399 10.6978 12.1792 12.3908 7.20862 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 4.43243 7.15062 9.51001 9.80618 11.094 4.71683 13.4561 16.9783 8.3795 9.13126 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 8.09021 15.4423 9.94957 12.4357 4.47698 7.52632 13.7732 10.3071 3.89234 9.50814 numMergedOcc 0
14 mol 265 unq 1 iso 0 dist 6.98451 11.3503 9.94957 9.56106 4.47698 7.52632 10.6329 10.3071 3.89234 9.50814 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 8.00278 5.53565 7.3055 10.6206 6.1113 6.57444 16.3948 10.0039 13.1376 9.63694 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 8.00278 5.53565 7.3055 10.6206 6.1113 6.57444 10.3186 10.8326 5.91091 6.58277 numMergedOcc 0
17 mol 266 unq 2 iso 0 dist 8.00278 5.53565 7.3055 9.4961 14.487 9.39714 10.3186 10.8326 5.91091 8.12204 numMergedOcc 0
18 mol 266 unq 3 iso 0 dist 6.13722 4.19938 7.3055 7.07099 6.1113 6.57444 14.7313 10.0039 13.1376 9.63694 numMergedOcc 0
19 mol 266 unq 4 iso 0 dist 6.13722 4.19938 7.3055 7.07099 6.1113 6.57444 7.14057 10.8326 5.91091 6.58277 numMergedOcc 0
20 mol 266 unq 5 iso 0 dist 6.13722 4.19938 7.3055 8.3978 14.487 9.39714 7.14057 10.8326 5.91091 8.12204 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.90634 5.05806 7.3388 9.04355 5.66584 6.96774 14.8194 12.4464 10.4601 8.0935 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.90634 11.1974 6.96248 9.04355 5.66584 7.14859 14.8194 12.4464 8.13485 8.0935 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 7.90634 5.05806 7.3388 9.04355 5.66584 6.96774 14.8194 12.4464 10.4601 8.0935 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 7.90634 11.1974 6.96248 9.04355 5.66584 7.14859 14.8194 12.4464 8.13485 8.0935 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 7.90634 5.05806 7.3388 9.04355 5.66584 6.96774 14.8194 12.4464 10.4601 8.0935 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 7.90634 11.1974 6.96248 9.04355 5.66584 7.14859 14.8194 12.4464 8.13485 8.0935 numMergedOcc 0
