0 mol 6 unq 0 iso 0 dist 6.1462 9.12796 4.09396 6.36157 8.54844 8.60722 4.59751 9.12718 12.884 10.7638 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.3147 9.79426 17.1338 8.75001 10.2713 12.053 4.55916 9.65404 13.738 12.3973 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 6.01454 8.36915 8.29103 9.53081 5.41488 13.2937 13.2371 8.96621 13.1337 11.4224 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 7.50126 5.12189 11.0817 9.2759 5.35551 10.8516 11.2716 8.60913 16.2282 12.1981 numMergedOcc 0
4 mol 220 unq 0 iso 0 dist 7.57712 7.20255 5.88344 5.25149 10.1832 9.96224 6.555 9.58724 12.5675 7.81237 numMergedOcc 0
5 mol 220 unq 1 iso 0 dist 7.57712 7.20255 5.88344 8.6368 13.4455 8.70221 6.555 9.58724 12.5675 14.9704 numMergedOcc 0
6 mol 223 unq 0 iso 0 dist 5.75896 9.29204 11.898 6.97426 10.6184 4.73988 6.5658 7.22882 10.9317 11.4192 numMergedOcc 0
7 mol 223 unq 1 iso 0 dist 5.75896 9.29204 11.898 8.87456 13.8469 8.36102 6.5658 7.22882 10.9317 13.9012 numMergedOcc 0
8 mol 223 unq 2 iso 0 dist 5.75896 9.14789 13.5741 6.97426 10.6184 4.78255 6.5658 7.22882 11.6333 11.4192 numMergedOcc 0
9 mol 223 unq 3 iso 0 dist 5.75896 9.14789 13.5741 8.87456 13.8469 5.43913 6.5658 7.22882 11.6333 13.9012 numMergedOcc 0
10 mol 223 unq 4 iso 0 dist 5.75896 7.80764 7.12929 6.97426 10.6184 12.6805 6.5658 7.22882 12.3717 11.4192 numMergedOcc 0
11 mol 223 unq 5 iso 0 dist 5.75896 7.80764 7.12929 8.87456 13.8469 13.9763 6.5658 7.22882 12.3717 13.9012 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 5.97988 9.37276 8.07582 8.81063 10.0093 4.19878 8.60417 9.79842 16.8131 16.8231 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 6.08181 7.70189 9.86352 8.10903 10.8957 5.27718 9.0655 7.66806 11.0415 14.766 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 6.08181 7.70189 9.86352 7.25618 11.0025 9.46467 9.0655 7.66806 11.0415 15.9916 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 6.58277 9.63694 15.3443 6.57444 5.91091 13.1376 4.56912 9.12381 10.7143 11.0001 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 6.58277 9.63694 15.3443 6.57444 5.91091 13.1376 8.89693 8.79148 16.8072 13.3746 numMergedOcc 0
17 mol 266 unq 2 iso 0 dist 6.58277 9.63694 15.3443 6.57444 5.91091 13.1376 14.5953 8.14167 22.9049 11.0568 numMergedOcc 0
18 mol 266 unq 3 iso 0 dist 6.58277 9.63694 15.3443 7.9555 3.93133 14.6225 4.56912 9.12381 10.7143 11.0616 numMergedOcc 0
19 mol 266 unq 4 iso 0 dist 6.58277 9.63694 15.3443 7.9555 3.93133 14.6225 8.89693 8.79148 16.8072 11.7745 numMergedOcc 0
20 mol 266 unq 5 iso 0 dist 6.58277 9.63694 15.3443 7.9555 3.93133 14.6225 14.5953 8.14167 22.9049 8.67354 numMergedOcc 0
21 mol 266 unq 6 iso 0 dist 8.42706 8.61786 11.4983 8.8646 3.93133 9.94141 5.43295 9.12381 13.8816 11.0616 numMergedOcc 0
22 mol 266 unq 7 iso 0 dist 8.42706 8.61786 11.4983 8.8646 3.93133 9.94141 7.37367 8.79148 13.0179 11.7745 numMergedOcc 0
23 mol 266 unq 8 iso 0 dist 8.42706 8.61786 11.4983 8.8646 3.93133 9.94141 15.7187 8.14167 14.7972 8.67354 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 5.76337 9.39625 4.46072 9.77023 7.87494 11.4878 5.78097 8.49287 10.1113 13.716 numMergedOcc 0
