0 mol 9 unq 0 iso 0 dist 6.8848 11.4699 8.48677 7.48843 8.59513 13.4295 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.8848 11.4699 8.48677 4.07023 6.59312 13.4414 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 8.3794 6.3431 6.42748 10.0572 6.31608 4.22652 numMergedOcc 0
3 mol 15 unq 1 iso 0 dist 8.3794 9.85033 7.48342 10.0572 6.31608 12.2746 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 7.67564 4.04716 5.78706 13.2666 7.54574 9.53244 numMergedOcc 0
5 mol 98 unq 1 iso 0 dist 7.67564 8.87226 7.23884 13.2666 7.54574 9.91282 numMergedOcc 0
6 mol 98 unq 2 iso 0 dist 7.67564 13.0429 5.59328 13.2666 7.54574 6.54016 numMergedOcc 0
7 mol 98 unq 3 iso 0 dist 7.67564 13.699 7.5242 13.2666 7.54574 11.2206 numMergedOcc 0
8 mol 98 unq 4 iso 0 dist 8.60103 4.75433 5.78706 8.734 7.54574 9.53244 numMergedOcc 0
9 mol 98 unq 5 iso 0 dist 8.60103 10.9049 7.23884 8.734 7.54574 9.91282 numMergedOcc 0
10 mol 98 unq 6 iso 0 dist 8.60103 11.5098 5.59328 8.734 7.54574 6.54016 numMergedOcc 0
11 mol 98 unq 7 iso 0 dist 8.60103 15.8069 7.5242 8.734 7.54574 11.2206 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 6.3322 6.29657 7.4671 4.80213 6.2771 4.46691 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 6.52844 6.13737 6.28565 4.39633 8.98175 10.3933 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 5.66405 13.0477 9.97343 12.6506 9.38036 6.45283 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 5.66405 6.64386 9.70413 12.6506 9.38036 11.3136 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 5.24076 10.9775 7.44629 3.60864 6.12453 12.7437 numMergedOcc 0
17 mol 168 unq 1 iso 0 dist 5.24076 10.9775 7.44629 7.08284 9.87447 14.4866 numMergedOcc 0
18 mol 249 unq 0 iso 0 dist 9.58168 12.8314 5.48118 5.33399 8.76518 10.3504 numMergedOcc 0
19 mol 249 unq 1 iso 0 dist 9.58168 11.6796 7.25858 5.33399 8.76518 10.9925 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 7.87648 14.0618 9.63959 11.8118 9.36974 4.83605 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 7.87648 6.96581 9.96262 11.8118 9.36974 8.21389 numMergedOcc 0
22 mol 258 unq 2 iso 0 dist 7.87648 5.38982 7.21311 11.8118 9.36974 11.9728 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 9.16554 4.77695 8.83865 12.6217 9.81919 9.32873 numMergedOcc 0
24 mol 273 unq 1 iso 0 dist 9.16554 10.3543 9.18157 12.6217 9.81919 5.04315 numMergedOcc 0
25 mol 273 unq 2 iso 0 dist 9.65597 15.0014 8.83865 14.5301 9.81919 9.32873 numMergedOcc 0
26 mol 273 unq 3 iso 0 dist 9.65597 16.3813 9.18157 14.5301 9.81919 5.04315 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 9.5144 15.5391 9.88863 9.43183 9.373 9.81399 numMergedOcc 0
