0 mol 20 unq 0 iso 0 dist 6.29237 9.24286 3.49913 9.74724 12.9564 15.7788 numMergedOcc 0
1 mol 20 unq 0 iso 1 dist 9.24286 6.29237 3.49913 9.74724 15.7788 12.9564 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 6.29237 9.24286 3.49913 9.13347 10.9428 13.8245 numMergedOcc 0
3 mol 20 unq 1 iso 1 dist 9.24286 6.29237 3.49913 9.13347 13.8245 10.9428 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.70016 5.13078 13.4516 7.18124 3.67206 11.1587 numMergedOcc 0
5 mol 24 unq 0 iso 1 dist 5.13078 8.70016 13.4516 7.18124 11.1587 3.67206 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 8.70016 5.13078 13.4516 6.47026 8.93303 8.72577 numMergedOcc 0
7 mol 24 unq 1 iso 1 dist 5.13078 8.70016 13.4516 6.47026 8.72577 8.93303 numMergedOcc 0
8 mol 24 unq 2 iso 0 dist 4.90881 6.15382 3.73215 8.10168 5.75365 3.67206 numMergedOcc 0
9 mol 24 unq 2 iso 1 dist 6.15382 4.90881 3.73215 8.10168 3.67206 5.75365 numMergedOcc 0
10 mol 30 unq 0 iso 0 dist 9.99577 8.40203 16.3119 8.28218 3.08756 13.6786 numMergedOcc 0
11 mol 30 unq 0 iso 1 dist 8.40203 9.99577 16.3119 8.28218 13.6786 3.08756 numMergedOcc 0
12 mol 30 unq 1 iso 0 dist 9.99577 8.40203 16.3119 8.10811 14.5119 3.40185 numMergedOcc 0
13 mol 30 unq 1 iso 1 dist 8.40203 9.99577 16.3119 8.10811 3.40185 14.5119 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 6.41507 6.03035 5.05513 8.46167 13.3691 9.59189 numMergedOcc 0
15 mol 113 unq 0 iso 1 dist 6.03035 6.41507 5.05513 8.46167 9.59189 13.3691 numMergedOcc 0
16 mol 113 unq 1 iso 0 dist 6.41507 6.03035 5.05513 6.13175 12.277 10.1118 numMergedOcc 0
17 mol 113 unq 1 iso 1 dist 6.03035 6.41507 5.05513 6.13175 10.1118 12.277 numMergedOcc 0
18 mol 113 unq 2 iso 0 dist 6.41507 6.03035 5.05513 4.34107 9.60282 8.19901 numMergedOcc 0
19 mol 113 unq 2 iso 1 dist 6.03035 6.41507 5.05513 4.34107 8.19901 9.60282 numMergedOcc 0
20 mol 135 unq 0 iso 0 dist 5.27399 5.72277 3.61409 7.74087 4.98191 5.83178 numMergedOcc 0
21 mol 135 unq 0 iso 1 dist 5.72277 5.27399 3.61409 7.74087 5.83178 4.98191 numMergedOcc 0
22 mol 135 unq 1 iso 0 dist 5.27399 5.72277 3.61409 8.53533 5.0759 5.9306 numMergedOcc 0
23 mol 135 unq 1 iso 1 dist 5.72277 5.27399 3.61409 8.53533 5.9306 5.0759 numMergedOcc 0
24 mol 135 unq 2 iso 0 dist 5.27399 9.79769 6.09264 7.74087 4.98191 7.56148 numMergedOcc 0
25 mol 135 unq 2 iso 1 dist 9.79769 5.27399 6.09264 7.74087 7.56148 4.98191 numMergedOcc 0
26 mol 135 unq 3 iso 0 dist 5.27399 9.79769 6.09264 8.53533 5.0759 8.3336 numMergedOcc 0
27 mol 135 unq 3 iso 1 dist 9.79769 5.27399 6.09264 8.53533 8.3336 5.0759 numMergedOcc 0
28 mol 135 unq 2 iso 0 dist 5.72277 9.79769 9.58817 7.74087 5.83178 7.56148 numMergedOcc 0
29 mol 135 unq 2 iso 1 dist 9.79769 5.72277 9.58817 7.74087 7.56148 5.83178 numMergedOcc 0
30 mol 135 unq 3 iso 0 dist 5.72277 9.79769 9.58817 8.53533 5.9306 8.3336 numMergedOcc 0
31 mol 135 unq 3 iso 1 dist 9.79769 5.72277 9.58817 8.53533 8.3336 5.9306 numMergedOcc 0
32 mol 154 unq 0 iso 0 dist 9.11555 8.88053 5.55204 9.82522 10.8387 6.13421 numMergedOcc 0
33 mol 154 unq 0 iso 1 dist 8.88053 9.11555 5.55204 9.82522 6.13421 10.8387 numMergedOcc 0
34 mol 154 unq 1 iso 0 dist 9.11555 8.88053 5.55204 8.50773 6.76318 7.24062 numMergedOcc 0
35 mol 154 unq 1 iso 1 dist 8.88053 9.11555 5.55204 8.50773 7.24062 6.76318 numMergedOcc 0
36 mol 158 unq 0 iso 0 dist 8.41697 9.2016 10.0033 9.67263 7.53461 15.3696 numMergedOcc 0
37 mol 158 unq 0 iso 1 dist 9.2016 8.41697 10.0033 9.67263 15.3696 7.53461 numMergedOcc 0
38 mol 283 unq 0 iso 0 dist 8.47034 8.57491 10.548 9.74797 13.7144 16.5101 numMergedOcc 0
39 mol 283 unq 0 iso 1 dist 8.57491 8.47034 10.548 9.74797 16.5101 13.7144 numMergedOcc 0
40 mol 283 unq 1 iso 0 dist 8.47034 8.57491 10.548 9.90494 3.12129 13.5298 numMergedOcc 0
41 mol 283 unq 1 iso 1 dist 8.57491 8.47034 10.548 9.90494 13.5298 3.12129 numMergedOcc 0
42 mol 287 unq 0 iso 0 dist 9.62446 9.99681 13.523 8.70479 11.4704 16.9251 numMergedOcc 0
43 mol 287 unq 0 iso 1 dist 9.99681 9.62446 13.523 8.70479 16.9251 11.4704 numMergedOcc 0
44 mol 288 unq 0 iso 0 dist 9.62446 9.99681 13.523 8.70479 11.4704 16.9251 numMergedOcc 0
45 mol 288 unq 0 iso 1 dist 9.99681 9.62446 13.523 8.70479 16.9251 11.4704 numMergedOcc 0
46 mol 289 unq 0 iso 0 dist 9.62446 9.99681 13.523 8.70479 11.4704 16.9251 numMergedOcc 0
47 mol 289 unq 0 iso 1 dist 9.99681 9.62446 13.523 8.70479 16.9251 11.4704 numMergedOcc 0
