0 mol 1 unq 0 iso 0 dist 6.35771 9.78282 7.73435 13.6058 7.94662 9.12196 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 7.70793 6.1146 5.00267 6.27477 5.02333 7.8922 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 5.21094 5.63384 5.63315 11.7209 10.2179 7.28416 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.32155 7.56926 7.31982 14.9909 7.05402 9.93832 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.32155 7.56926 7.31982 9.16827 5.48048 8.60739 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 9.2746 6.0453 8.03035 10.5727 4.91132 7.77116 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 9.89116 12.9632 8.03035 13.3176 4.99056 7.99857 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 9.89116 12.9632 8.03035 8.59784 3.78311 8.56342 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 9.89116 4.31572 7.6968 8.59784 3.78311 6.37542 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 7.52352 4.88215 5.73236 8.72463 10.8441 8.41611 numMergedOcc 0
10 mol 143 unq 1 iso 0 dist 7.23619 10.8542 5.73236 16.1156 10.8441 8.41611 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 8.63783 13.516 5.90883 13.4954 6.44255 5.38091 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 7.96867 10.6551 4.9941 13.4954 5.82636 7.73169 numMergedOcc 0
13 mol 156 unq 2 iso 0 dist 7.96867 13.516 8.06913 13.4954 5.82636 5.38091 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 7.64106 14.604 7.3546 10.6529 6.94217 8.38738 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 9.54732 5.9285 7.82546 10.4371 4.44751 7.71426 numMergedOcc 0
16 mol 171 unq 1 iso 0 dist 9.54732 5.9285 7.82546 10.51 9.61561 5.10618 numMergedOcc 0
17 mol 171 unq 2 iso 0 dist 9.54732 5.9285 7.82546 10.8952 10.2067 9.86681 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.52129 10.4401 9.89583 9.29203 10.7508 6.66971 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 6.52129 10.4401 9.89583 7.62771 5.87253 6.4398 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 6.52129 10.4401 9.89583 7.80166 10.7551 7.32982 numMergedOcc 0
21 mol 294 unq 0 iso 0 dist 9.99345 11.2327 7.41079 11.8926 12.0308 9.13907 numMergedOcc 0
