0 mol 7 unq 0 iso 0 dist 7.11539 5.37308 6.02702 6.44558 6.14469 6.55304 12.421 8.43473 9.60499 6.7985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.11539 5.37308 6.02702 6.44558 6.14469 6.55304 12.0334 5.03847 10.6581 9.68596 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.11539 9.17482 8.72114 6.44558 6.14469 6.34041 12.421 8.43473 11.0773 6.7985 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.11539 9.17482 8.72114 6.44558 6.14469 6.34041 12.0334 5.03847 10.5461 9.68596 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 8.37378 6.78983 5.89412 7.11548 6.03257 9.75966 6.60595 10.1154 11.3543 6.42748 numMergedOcc 0
5 mol 15 unq 1 iso 0 dist 8.37378 6.78983 5.89412 7.11548 6.03257 9.75966 12.0433 4.29582 9.88835 7.48342 numMergedOcc 0
6 mol 15 unq 2 iso 0 dist 8.37378 9.50843 7.07399 7.11548 6.03257 4.39605 6.60595 10.1154 10.6338 6.42748 numMergedOcc 0
7 mol 15 unq 3 iso 0 dist 8.37378 9.50843 7.07399 7.11548 6.03257 4.39605 12.0433 4.29582 8.38064 7.48342 numMergedOcc 0
8 mol 15 unq 4 iso 0 dist 8.3794 6.3431 6.42748 7.49229 6.03257 10.1154 6.82187 9.75966 11.3543 5.89412 numMergedOcc 0
9 mol 15 unq 5 iso 0 dist 8.3794 6.3431 6.42748 7.49229 6.03257 10.1154 12.0227 4.39605 10.6338 7.07399 numMergedOcc 0
10 mol 15 unq 6 iso 0 dist 8.3794 9.85033 7.48342 7.49229 6.03257 4.29582 6.82187 9.75966 9.88835 5.89412 numMergedOcc 0
11 mol 15 unq 7 iso 0 dist 8.3794 9.85033 7.48342 7.49229 6.03257 4.29582 12.0227 4.39605 8.38064 7.07399 numMergedOcc 0
12 mol 91 unq 0 iso 0 dist 7.12701 5.96173 5.73743 5.06999 8.66165 10.1024 9.87709 4.57085 10.2307 9.30539 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 6.52844 6.13737 6.28565 7.72162 9.73158 10.7293 8.59695 4.55551 5.83384 9.36851 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 6.52844 6.13737 6.28565 7.95267 7.59327 7.29399 8.59695 4.55551 5.83384 4.97175 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 8.75305 10.6289 7.30357 5.6621 8.21184 5.81563 8.50926 10.8404 11.6719 9.00416 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 8.75305 10.6289 7.30357 6.65278 5.41575 5.52796 13.7542 6.14767 10.2717 8.73722 numMergedOcc 0
17 mol 156 unq 2 iso 0 dist 5.13522 10.6289 8.61587 5.6621 5.9976 5.81563 8.50926 5.18356 11.6719 9.00416 numMergedOcc 0
18 mol 156 unq 3 iso 0 dist 5.13522 10.6289 8.61587 6.65278 6.86566 5.52796 13.7542 12.212 10.2717 8.73722 numMergedOcc 0
19 mol 171 unq 0 iso 0 dist 8.29782 4.97028 6.64834 5.66419 5.25109 4.78075 9.48418 11.5561 13.05 9.61462 numMergedOcc 0
20 mol 171 unq 1 iso 0 dist 8.29782 7.69281 5.93786 5.66419 5.25109 7.9651 9.48418 11.5561 14.9792 9.61462 numMergedOcc 0
21 mol 171 unq 2 iso 0 dist 8.29782 12.3639 8.24693 5.66419 5.25109 12.6853 9.48418 11.5561 16.2078 9.61462 numMergedOcc 0
22 mol 171 unq 3 iso 0 dist 8.29782 9.82561 7.36698 5.66419 5.25109 5.90026 9.48418 11.5561 15.4802 9.61462 numMergedOcc 0
23 mol 171 unq 4 iso 0 dist 7.61144 10.307 8.1344 13.5731 8.21618 7.9651 13.5708 10.844 14.9792 9.61462 numMergedOcc 0
24 mol 171 unq 5 iso 0 dist 7.61144 5.60928 6.71356 13.5731 8.21618 12.6853 13.5708 10.844 16.2078 9.61462 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 8.90567 5.4328 6.59025 8.96857 8.86197 7.81713 12.1707 8.04639 8.03334 6.2479 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 8.90567 5.4328 6.59025 8.96857 8.86197 7.81713 13.8315 13.0409 10.9639 6.22122 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 8.90567 5.4328 6.59025 8.96857 8.86197 7.81713 11.6518 5.77299 10.7062 7.99195 numMergedOcc 0
28 mol 181 unq 3 iso 0 dist 9.2933 5.32364 5.9176 5.10499 7.22883 6.29863 14.5548 12.7358 15.333 9.72611 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 6.80544 5.65008 8.69104 4.04422 5.92374 8.1195 11.4073 5.50308 13.9668 8.94014 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 6.80544 5.65008 8.69104 4.04422 5.92374 8.1195 10.6583 7.11984 12.8275 7.02333 numMergedOcc 0
31 mol 238 unq 2 iso 0 dist 6.80544 5.65008 8.69104 4.04422 5.92374 8.1195 11.147 7.95232 10.7456 8.67864 numMergedOcc 0
32 mol 271 unq 0 iso 0 dist 6.85471 5.49799 9.70714 4.17949 5.92274 8.66946 11.2198 5.53238 15.085 8.98576 numMergedOcc 0
33 mol 271 unq 1 iso 0 dist 6.85471 5.49799 9.70714 4.17949 5.92274 8.66946 12.8668 9.1619 16.6378 8.92636 numMergedOcc 0
34 mol 273 unq 0 iso 0 dist 9.16554 4.77695 8.83865 11.4694 7.16346 12.0136 12.9809 4.60101 13.3579 8.49177 numMergedOcc 0
35 mol 273 unq 1 iso 0 dist 9.16554 10.3543 9.18157 11.4694 7.16346 12.1851 12.9809 4.60101 13.4294 8.49177 numMergedOcc 0
36 mol 273 unq 2 iso 0 dist 9.65597 15.0014 8.83865 4.73332 7.16346 12.0136 9.37841 4.60101 13.3579 8.49177 numMergedOcc 0
37 mol 273 unq 3 iso 0 dist 9.65597 16.3813 9.18157 4.73332 7.16346 12.1851 9.37841 4.60101 13.4294 8.49177 numMergedOcc 0
