0 mol 41 unq 0 iso 0 dist 9.59131 6.51139 13.4526 8.0072 9.00425 9.28138 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 9.59131 6.91278 11.3802 8.0072 9.00425 4.98483 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 9.25641 7.44869 4.38569 7.61923 14.0111 14.1388 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 9.14996 8.18251 3.98752 7.57749 5.91159 6.28248 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 9.14996 5.02642 7.08886 7.57749 5.91159 3.66253 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.74131 5.55798 4.20398 8.59739 3.80156 5.71097 numMergedOcc 0
6 mol 81 unq 0 iso 0 dist 5.96486 8.9672 4.57548 5.73799 3.71228 3.82386 numMergedOcc 0
7 mol 81 unq 1 iso 0 dist 5.96486 8.9672 4.57548 8.38883 7.58448 11.9686 numMergedOcc 0
8 mol 81 unq 2 iso 0 dist 5.96486 9.80754 8.00722 5.73799 3.71228 11.4429 numMergedOcc 0
9 mol 81 unq 3 iso 0 dist 5.96486 9.80754 8.00722 8.38883 7.58448 4.54161 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 9.0455 6.65878 4.74644 8.09774 9.05571 6.31483 numMergedOcc 0
11 mol 139 unq 0 iso 0 dist 8.49892 9.71665 4.19005 7.02063 4.37138 3.82037 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.10223 8.65008 3.82471 5.06116 5.18463 7.59527 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 6.91762 9.22494 9.32017 7.25009 5.05961 12.7495 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 8.44483 6.09291 11.8115 6.00783 8.55252 7.58935 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 9.79864 6.09291 12.8928 6.00783 5.37021 7.58935 numMergedOcc 0
16 mol 169 unq 2 iso 0 dist 9.73241 6.09291 11.3409 6.00783 8.90362 7.58935 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 9.80584 5.21088 8.61606 7.93715 9.82173 6.62595 numMergedOcc 0
18 mol 192 unq 1 iso 0 dist 9.80584 9.78743 19.1942 7.93715 9.82173 13.2141 numMergedOcc 0
19 mol 192 unq 2 iso 0 dist 9.80584 8.25609 4.97164 7.93715 9.82173 12.1003 numMergedOcc 0
20 mol 192 unq 3 iso 0 dist 7.95713 5.21088 5.41356 7.93715 9.52963 6.62595 numMergedOcc 0
21 mol 192 unq 4 iso 0 dist 7.95713 9.78743 16.5293 7.93715 9.52963 13.2141 numMergedOcc 0
22 mol 192 unq 5 iso 0 dist 7.95713 8.25609 4.87986 7.93715 9.52963 12.1003 numMergedOcc 0
23 mol 195 unq 0 iso 0 dist 8.97651 9.35664 11.0735 9.48766 8.34322 6.04748 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 5.29561 9.84479 11.4949 9.85909 6.05991 14.8057 numMergedOcc 0
25 mol 232 unq 1 iso 0 dist 5.29561 9.82645 11.8349 9.85909 6.05991 15.8965 numMergedOcc 0
26 mol 232 unq 2 iso 0 dist 9.16638 9.84479 14.347 9.85909 15.9224 14.8057 numMergedOcc 0
27 mol 232 unq 3 iso 0 dist 9.16638 9.82645 9.07946 9.85909 15.9224 15.8965 numMergedOcc 0
28 mol 233 unq 0 iso 0 dist 9.80133 7.20629 6.66728 8.84037 8.42306 3.80398 numMergedOcc 0
29 mol 233 unq 1 iso 0 dist 9.80133 6.5622 5.24667 8.84037 8.42306 5.62929 numMergedOcc 0
30 mol 233 unq 2 iso 0 dist 7.74693 8.01777 13.8942 8.7831 4.98419 12.6648 numMergedOcc 0
31 mol 233 unq 3 iso 0 dist 7.74693 8.01777 13.8942 9.61071 7.08719 13.8023 numMergedOcc 0
32 mol 233 unq 4 iso 0 dist 7.74693 8.01777 13.8942 7.1229 10.7478 8.98854 numMergedOcc 0
33 mol 233 unq 5 iso 0 dist 7.74693 9.44671 11.8011 5.76164 3.98113 7.87864 numMergedOcc 0
34 mol 233 unq 6 iso 0 dist 7.74693 7.21531 5.89828 5.76164 3.98113 4.74962 numMergedOcc 0
35 mol 237 unq 0 iso 0 dist 9.18638 9.88041 14.0639 9.58403 5.80771 10.5069 numMergedOcc 0
36 mol 238 unq 0 iso 0 dist 7.82564 5.83514 5.64173 6.96382 3.72761 4.70535 numMergedOcc 0
37 mol 238 unq 1 iso 0 dist 9.51177 5.83514 4.11566 6.96382 5.17342 4.70535 numMergedOcc 0
38 mol 244 unq 0 iso 0 dist 5.06669 9.06357 5.11058 9.11416 12.7525 16.2635 numMergedOcc 0
39 mol 244 unq 1 iso 0 dist 5.65248 9.06357 10.8525 9.11416 7.99094 16.2635 numMergedOcc 0
40 mol 247 unq 0 iso 0 dist 8.67304 9.21409 8.17977 9.01651 7.1875 3.42642 numMergedOcc 0
41 mol 283 unq 0 iso 0 dist 8.36393 5.90728 4.01355 8.4275 3.77125 5.55396 numMergedOcc 0
42 mol 285 unq 0 iso 0 dist 8.12306 7.38536 8.7778 8.69325 7.22841 10.5146 numMergedOcc 0
43 mol 285 unq 1 iso 0 dist 8.12306 7.38536 8.7778 5.09181 6.01574 4.4744 numMergedOcc 0
