0 mol 26 unq 0 iso 0 dist 9.46609 6.17217 5.66783 9.54853 9.41425 11.4138 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.37544 6.66861 8.02931 14.7907 9.63353 15.5836 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 4.92955 6.72084 8.02931 9.78016 9.63353 15.5836 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 8.42713 7.4518 14.7862 14.4533 6.46217 20.257 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 8.42713 9.1687 9.42916 14.4533 6.46217 11.4742 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 6.20553 5.37302 7.76807 3.77247 8.28325 5.35711 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 5.82501 7.48533 8.66057 5.40104 6.4569 10.9536 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 6.4416 9.49761 8.06011 7.67031 7.12765 11.8543 numMergedOcc 0
8 mol 128 unq 1 iso 0 dist 6.4416 9.49761 8.06011 4.62046 6.28471 12.3001 numMergedOcc 0
9 mol 128 unq 2 iso 0 dist 6.4416 6.03154 5.19611 7.67031 7.12765 10.8446 numMergedOcc 0
10 mol 128 unq 3 iso 0 dist 6.4416 6.03154 5.19611 4.62046 6.28471 7.4442 numMergedOcc 0
11 mol 128 unq 4 iso 0 dist 6.91935 9.38436 8.06011 4.79627 7.12765 11.8543 numMergedOcc 0
12 mol 128 unq 5 iso 0 dist 6.91935 9.38436 8.06011 4.769 6.28471 12.3001 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 5.04351 8.09482 7.59769 10.8094 8.71836 14.5913 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 5.80513 9.62943 8.55624 5.5479 9.40912 12.6932 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 6.29631 5.51388 7.77054 3.89732 8.21203 5.41121 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 5.36078 9.51638 11.4153 12.3916 9.02222 14.0859 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 5.31079 6.32097 3.95218 6.66492 5.37154 9.07881 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 8.35521 9.73592 11.6632 10.0947 9.2182 18.4244 numMergedOcc 0
19 mol 270 unq 0 iso 0 dist 4.95899 8.55914 8.65019 4.67653 8.38298 11.1172 numMergedOcc 0
20 mol 270 unq 1 iso 0 dist 4.95899 8.41507 7.31363 4.67653 8.38298 12.8676 numMergedOcc 0
21 mol 286 unq 0 iso 0 dist 7.77655 8.23877 11.0947 3.85003 7.43339 11.7293 numMergedOcc 0
