0 mol 129 unq 0 iso 0 dist 5.16531 7.03404 6.52844 6.38163 6.13737 6.28565 numMergedOcc 0
1 mol 129 unq 1 iso 0 dist 6.65878 6.15789 9.7113 12.0922 11.462 7.58957 numMergedOcc 0
2 mol 130 unq 0 iso 0 dist 8.17814 10.009 7.7461 17.063 14.5095 9.72053 numMergedOcc 0
3 mol 130 unq 1 iso 0 dist 8.17814 10.009 7.7461 15.1647 10.449 7.7949 numMergedOcc 0
4 mol 130 unq 2 iso 0 dist 9.14434 15.9635 7.7461 20.0242 14.5095 9.72053 numMergedOcc 0
5 mol 130 unq 3 iso 0 dist 9.14434 15.9635 7.7461 19.5186 10.449 7.7949 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 5.83682 3.98821 8.809 11.0728 10.6249 9.90168 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 5.96301 8.92612 8.75305 12.8357 10.6289 7.30357 numMergedOcc 0
8 mol 156 unq 1 iso 0 dist 5.96301 4.24324 5.13522 12.8357 10.6289 8.61587 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 8.03695 4.13881 5.99212 8.25167 5.00649 6.45896 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 5.60956 6.62718 5.24076 13.3351 10.9775 7.44629 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 6.36789 4.11297 8.91143 10.4693 11.3133 7.66165 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 9.04342 11.2657 9.854 15.7128 9.70055 6.95086 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 8.09185 9.39384 6.80332 5.87223 5.3615 9.74144 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 8.09185 5.94698 7.64336 5.87223 5.3615 7.15603 numMergedOcc 0
15 mol 212 unq 2 iso 0 dist 7.27225 4.69067 6.80332 8.062 5.3615 9.74144 numMergedOcc 0
16 mol 212 unq 3 iso 0 dist 7.27225 4.18086 7.64336 8.062 5.3615 7.15603 numMergedOcc 0
17 mol 212 unq 4 iso 0 dist 8.14212 5.37854 6.80332 8.70011 5.3615 9.74144 numMergedOcc 0
18 mol 212 unq 5 iso 0 dist 8.14212 3.74692 7.64336 8.70011 5.3615 7.15603 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.91128 12.6625 9.49129 14.0632 5.65008 7.57812 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 9.91128 12.6625 9.49129 18.9144 14.6188 9.24557 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 9.91128 6.5335 6.80544 14.0632 5.65008 8.69104 numMergedOcc 0
22 mol 243 unq 0 iso 0 dist 8.6336 5.40441 9.18477 11.9954 10.2378 7.49645 numMergedOcc 0
23 mol 243 unq 1 iso 0 dist 8.6336 5.40441 9.18477 13.073 7.64721 9.9222 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 8.43002 10.318 7.87648 19.6221 14.0618 9.63959 numMergedOcc 0
25 mol 258 unq 1 iso 0 dist 8.43002 10.318 7.87648 13.9381 6.96581 9.96262 numMergedOcc 0
26 mol 258 unq 2 iso 0 dist 8.43002 10.318 7.87648 10.2123 5.38982 7.21311 numMergedOcc 0
