0 mol 16 unq 0 iso 0 dist 8.46837 6.84569 6.43294 5.46269 9.79958 5.46498 9.59856 5.45161 5.32694 7.63133 11.958 8.33883 10.9143 10.8455 6.31718 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.53564 9.17086 10.323 5.90113 9.74445 8.80331 10.615 14.445 8.13395 6.20293 7.74524 13.964 10.5523 5.06502 5.73819 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.53564 9.17086 10.323 5.90113 9.74445 8.80331 10.615 14.445 8.13395 6.20293 10.5661 15.3221 14.7803 6.45462 8.93915 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 7.84699 8.124 5.2774 13.4367 6.89722 6.19304 10.1112 10.4716 5.4148 9.96396 5.33851 11.7436 10.2049 15.7123 9.38498 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 7.84699 8.124 5.2774 13.4367 6.89722 6.19304 10.1112 10.4716 5.4148 9.96396 15.7164 14.4206 11.6369 12.016 9.75218 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.40844 8.124 5.44275 13.4367 7.26679 6.19304 10.1112 8.31041 5.4148 9.96396 5.33851 9.68526 10.2049 15.7123 9.38498 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 8.40844 8.124 5.44275 13.4367 7.26679 6.19304 10.1112 8.31041 5.4148 9.96396 15.7164 9.30776 11.6369 12.016 9.75218 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 6.99156 8.124 8.0624 13.4367 10.1503 6.19304 10.1112 11.7069 5.4148 9.96396 5.33851 9.72442 10.2049 15.7123 9.38498 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 6.99156 8.124 8.0624 13.4367 10.1503 6.19304 10.1112 11.7069 5.4148 9.96396 15.7164 13.2514 11.6369 12.016 9.75218 numMergedOcc 0
9 mol 73 unq 6 iso 0 dist 7.02351 8.16299 11.2674 10.3774 7.26679 8.70481 11.0108 8.31041 14.9342 9.96396 13.6586 9.68526 20.257 15.7123 9.38498 numMergedOcc 0
10 mol 73 unq 7 iso 0 dist 7.02351 8.16299 11.2674 10.3774 7.26679 8.70481 11.0108 8.31041 14.9342 9.96396 4.15333 9.30776 10.1207 12.016 9.75218 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 5.24519 8.81172 6.29427 5.34484 7.70533 9.84395 11.6152 14.3476 13.1058 7.90328 11.8951 14.7579 16.5575 7.22206 7.83136 numMergedOcc 0
12 mol 117 unq 1 iso 0 dist 5.24519 8.81172 6.29427 5.34484 7.70533 9.84395 11.6152 14.3476 13.1058 7.90328 11.7058 16.223 17.163 9.3584 7.0603 numMergedOcc 0
13 mol 142 unq 0 iso 0 dist 9.5355 7.15087 13.1936 8.68855 7.57458 9.2313 10.5719 12.288 5.50998 7.73169 5.50176 10.5524 5.31024 5.32922 7.26382 numMergedOcc 0
14 mol 142 unq 1 iso 0 dist 9.5355 7.15087 13.1936 5.50176 10.5524 5.31024 10.5719 12.288 5.50998 7.26382 8.68855 7.57458 9.2313 5.32922 7.73169 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 6.67598 9.19499 5.0966 5.66289 7.30021 7.44554 7.11647 5.75141 5.56175 8.94056 5.59399 10.6034 12.0598 10.1658 7.66148 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 8.98636 9.19499 8.58765 5.66289 12.0043 7.44554 7.11647 5.6208 5.56175 8.94056 5.59399 10.2601 12.0598 10.1658 7.66148 numMergedOcc 0
17 mol 156 unq 2 iso 0 dist 8.79185 9.19499 9.07974 5.66289 10.0734 7.44554 7.11647 5.70205 5.56175 8.94056 5.59399 6.71202 12.0598 10.1658 7.66148 numMergedOcc 0
18 mol 156 unq 3 iso 0 dist 9.04176 9.68507 4.08699 9.75709 10.543 7.66148 10.2339 9.75421 10.1658 8.94056 11.0374 13.7555 12.0598 5.56175 7.44554 numMergedOcc 0
19 mol 156 unq 4 iso 0 dist 9.04176 9.68507 4.08699 9.75709 10.543 7.66148 10.2339 9.75421 10.1658 8.94056 7.90642 15.0146 15.1382 11.2719 9.83699 numMergedOcc 0
20 mol 156 unq 5 iso 0 dist 9.41152 7.98018 4.7382 4.68187 12.6493 9.83699 11.8093 14.3164 11.2719 8.94056 12.2852 16.4093 15.1382 10.1658 7.66148 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 8.03259 8.90247 6.94401 5.114 11.2315 9.1374 10.3907 13.9623 8.88798 5.98885 13.526 19.605 15.0228 10.1912 9.09537 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.68767 9.73411 14.3302 9.81806 15.9877 6.57273 10.1632 12.6092 5.0744 6.60589 8.98459 11.9715 10.103 6.77699 6.65832 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 8.68767 9.73411 14.3302 9.81806 15.9877 6.57273 10.1632 12.6092 5.0744 6.60589 5.99647 12.7282 5.78342 8.49799 9.16166 numMergedOcc 0
24 mol 224 unq 2 iso 0 dist 8.68767 9.73411 14.3302 5.99647 12.7282 5.78342 10.1632 12.6092 5.0744 9.16166 8.98459 11.9715 10.103 11.328 6.65832 numMergedOcc 0
25 mol 224 unq 3 iso 0 dist 8.68767 9.73411 14.3302 5.99647 12.7282 5.78342 10.1632 12.6092 5.0744 9.16166 9.81806 15.9877 6.57273 8.49799 6.60589 numMergedOcc 0
26 mol 224 unq 4 iso 0 dist 8.68767 7.75485 9.74911 5.99647 12.7282 5.81334 9.73411 14.3302 5.60236 5.78342 14.1073 20.6047 14.0676 11.5372 8.95269 numMergedOcc 0
27 mol 224 unq 5 iso 0 dist 8.68767 7.75485 9.74911 5.99647 12.7282 5.81334 9.73411 14.3302 5.60236 5.78342 9.81806 15.9877 10.5128 8.49799 6.57273 numMergedOcc 0
28 mol 224 unq 6 iso 0 dist 8.68767 7.75485 9.74911 5.99647 12.7282 5.81334 10.1632 12.6092 6.91102 9.16166 8.98459 11.9715 10.9745 11.328 6.65832 numMergedOcc 0
29 mol 224 unq 7 iso 0 dist 8.68767 7.75485 9.74911 5.99647 12.7282 5.81334 10.1632 12.6092 6.91102 9.16166 9.81806 15.9877 10.5128 8.49799 6.60589 numMergedOcc 0
30 mol 224 unq 8 iso 0 dist 7.7163 7.07564 5.63485 10.8463 9.79616 6.57273 12.0295 9.36962 5.0744 6.60589 15.6183 14.828 10.103 6.77699 6.65832 numMergedOcc 0
31 mol 224 unq 9 iso 0 dist 7.7163 7.07564 5.63485 10.8463 9.79616 6.57273 12.0295 9.36962 5.0744 6.60589 5.44863 10.0081 5.78342 8.49799 9.16166 numMergedOcc 0
32 mol 224 unq 10 iso 0 dist 7.7163 7.07564 5.63485 5.44863 10.0081 5.78342 12.0295 9.36962 5.0744 9.16166 15.6183 14.828 10.103 11.328 6.65832 numMergedOcc 0
33 mol 224 unq 11 iso 0 dist 7.7163 7.07564 5.63485 5.44863 10.0081 5.78342 12.0295 9.36962 5.0744 9.16166 10.8463 9.79616 6.57273 8.49799 6.60589 numMergedOcc 0
34 mol 224 unq 12 iso 0 dist 7.7163 9.11052 10.3532 5.44863 10.0081 5.81334 7.07564 5.63485 5.60236 5.78342 11.8217 9.34636 14.0676 11.5372 8.95269 numMergedOcc 0
35 mol 224 unq 13 iso 0 dist 7.7163 9.11052 10.3532 5.44863 10.0081 5.81334 7.07564 5.63485 5.60236 5.78342 10.8463 9.79616 10.5128 8.49799 6.57273 numMergedOcc 0
36 mol 224 unq 14 iso 0 dist 7.7163 9.11052 10.3532 5.44863 10.0081 5.81334 12.0295 9.36962 6.91102 9.16166 15.6183 14.828 10.9745 11.328 6.65832 numMergedOcc 0
37 mol 224 unq 15 iso 0 dist 7.7163 9.11052 10.3532 5.44863 10.0081 5.81334 12.0295 9.36962 6.91102 9.16166 10.8463 9.79616 10.5128 8.49799 6.60589 numMergedOcc 0
38 mol 224 unq 16 iso 0 dist 9.2 7.07564 4.8786 10.8463 11.1052 6.57273 12.0295 7.18448 5.0744 6.60589 15.6183 13.5897 10.103 6.77699 6.65832 numMergedOcc 0
39 mol 224 unq 17 iso 0 dist 9.2 7.07564 4.8786 10.8463 11.1052 6.57273 12.0295 7.18448 5.0744 6.60589 5.44863 9.29703 5.78342 8.49799 9.16166 numMergedOcc 0
40 mol 224 unq 18 iso 0 dist 9.2 7.07564 4.8786 5.44863 9.29703 5.78342 12.0295 7.18448 5.0744 9.16166 15.6183 13.5897 10.103 11.328 6.65832 numMergedOcc 0
41 mol 224 unq 19 iso 0 dist 9.2 7.07564 4.8786 5.44863 9.29703 5.78342 12.0295 7.18448 5.0744 9.16166 10.8463 11.1052 6.57273 8.49799 6.60589 numMergedOcc 0
42 mol 224 unq 20 iso 0 dist 9.2 9.11052 6.38066 5.44863 9.29703 5.81334 7.07564 4.8786 5.60236 5.78342 11.8217 12.8171 14.0676 11.5372 8.95269 numMergedOcc 0
43 mol 224 unq 21 iso 0 dist 9.2 9.11052 6.38066 5.44863 9.29703 5.81334 7.07564 4.8786 5.60236 5.78342 10.8463 11.1052 10.5128 8.49799 6.57273 numMergedOcc 0
44 mol 224 unq 22 iso 0 dist 9.2 9.11052 6.38066 5.44863 9.29703 5.81334 12.0295 7.18448 6.91102 9.16166 15.6183 13.5897 10.9745 11.328 6.65832 numMergedOcc 0
45 mol 224 unq 23 iso 0 dist 9.2 9.11052 6.38066 5.44863 9.29703 5.81334 12.0295 7.18448 6.91102 9.16166 10.8463 11.1052 10.5128 8.49799 6.60589 numMergedOcc 0
46 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 5.841 9.17826 7.55216 12.9898 14.9329 12.4689 7.22101 7.74349 13.0242 10.0334 4.39704 7.09863 numMergedOcc 0
47 mol 259 unq 0 iso 0 dist 7.4294 5.75874 6.9607 5.20592 10.3594 8.53687 10.9903 15.8193 10.582 8.13497 6.80302 13.8212 10.5767 4.69778 7.88519 numMergedOcc 0
48 mol 259 unq 1 iso 0 dist 8.37253 5.75874 6.68041 5.20592 12.6542 8.53687 10.9903 14.0237 10.582 8.13497 6.80302 12.3765 10.5767 4.69778 7.88519 numMergedOcc 0
49 mol 261 unq 0 iso 0 dist 9.56414 9.95681 4.50761 5.79827 10.2386 8.02547 10.8774 12.8629 10.0727 8.43057 8.69153 15.0511 14.2688 10.1239 7.73141 numMergedOcc 0
50 mol 261 unq 1 iso 0 dist 9.56414 9.05762 8.80293 5.79827 10.2386 6.05727 10.8774 12.8629 4.63549 8.43057 8.69153 15.0511 10.0703 10.1239 7.73141 numMergedOcc 0
