0 mol 48 unq 0 iso 0 dist 7.38928 5.35252 5.03338 9.40644 8.74683 5.43494 5.76698 12.5606 8.8645 10.4843 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.4438 4.34694 9.65371 7.58027 9.96367 3.73929 4.93697 7.75341 7.47162 10.2801 numMergedOcc 0
2 mol 159 unq 0 iso 0 dist 7.60912 9.9368 13.4546 9.54337 6.50839 14.3749 15.7186 19.6156 9.45909 22.6555 numMergedOcc 0
3 mol 159 unq 1 iso 0 dist 7.60912 9.9368 13.4546 6.86212 8.83633 4.82545 15.7186 19.6156 9.45909 13.1022 numMergedOcc 0
4 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 8.72949 8.01622 10.4327 13.4486 13.507 8.09915 14.9175 numMergedOcc 0
5 mol 223 unq 0 iso 0 dist 9.29204 8.87456 8.36102 6.97426 4.73988 4.71901 13.934 17.9562 9.94483 14.0141 numMergedOcc 0
6 mol 223 unq 1 iso 0 dist 9.14789 8.87456 5.43913 6.97426 4.78255 4.71901 13.934 14.497 9.94483 14.0141 numMergedOcc 0
7 mol 223 unq 2 iso 0 dist 7.80764 8.87456 13.9763 6.97426 12.6805 4.71901 13.934 15.509 9.94483 14.0141 numMergedOcc 0
8 mol 223 unq 3 iso 0 dist 5.75896 8.87456 13.8469 6.97426 10.6184 4.71901 13.934 19.0188 9.94483 14.0141 numMergedOcc 0
9 mol 244 unq 0 iso 0 dist 6.51428 7.79787 13.4155 7.43391 4.69664 12.5222 8.65358 13.2708 8.93589 15.3887 numMergedOcc 0
10 mol 245 unq 0 iso 0 dist 8.26223 8.0848 4.03241 9.5096 4.20594 7.00614 7.79753 11.6259 9.62608 11.4734 numMergedOcc 0
11 mol 249 unq 0 iso 0 dist 7.58833 3.67935 4.88298 8.00386 10.9665 6.79958 6.46469 9.1515 8.56493 14.1386 numMergedOcc 0
12 mol 249 unq 1 iso 0 dist 9.04715 3.67935 5.75331 8.00386 5.52082 6.79958 6.46469 14.1233 8.56493 14.1386 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 9.77392 9.0836 16.492 9.62494 18.9489 5.40028 7.90149 14.1584 8.9221 9.51145 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 9.77392 9.62494 18.9489 9.0836 16.492 5.40028 7.90149 14.1584 9.51145 8.9221 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 8.0935 7.14859 8.13485 6.96774 10.4601 7.11169 13.8618 14.152 8.43856 15.2073 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 8.0935 7.14859 8.13485 6.96774 10.4601 7.11169 13.8618 14.152 8.43856 15.2073 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 8.0935 7.14859 8.13485 6.96774 10.4601 7.11169 13.8618 14.152 8.43856 15.2073 numMergedOcc 0
