0 mol 24 unq 0 iso 0 dist 9.01567 8.92779 7.03544 7.29868 6.16544 4.30252 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.01567 9.76111 6.93597 12.2059 4.15946 5.9372 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.4051 8.03955 4.30252 9.83002 6.16544 7.03544 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 7.29868 8.92779 4.30252 9.01567 6.16544 7.03544 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 8.60554 12.3897 4.30252 13.4393 6.16544 7.03544 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 8.8822 15.3211 7.40338 9.66219 4.09459 6.23759 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 9.66219 15.3211 6.23759 8.8822 4.09459 7.40338 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 7.70232 4.46691 6.5788 11.0563 8.29726 9.82836 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 7.70232 4.46691 6.5788 7.4671 4.04941 6.2771 numMergedOcc 0
9 mol 117 unq 2 iso 0 dist 7.4671 4.46691 6.2771 11.0563 11.9492 9.82836 numMergedOcc 0
10 mol 117 unq 3 iso 0 dist 7.4671 4.46691 6.2771 7.70232 4.04941 6.5788 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 9.97343 6.45283 9.38036 13.5519 6.59975 9.35867 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 9.70413 11.3136 9.38036 11.7346 6.59975 9.35867 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 8.84535 10.4935 5.95148 13.867 5.54669 6.73137 numMergedOcc 0
14 mol 146 unq 1 iso 0 dist 8.82188 4.19745 5.95148 10.0609 5.54669 6.73137 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 9.91993 4.73245 9.17462 6.22055 4.32771 5.75959 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 9.91993 4.73245 9.17462 9.33629 5.84014 6.6946 numMergedOcc 0
17 mol 148 unq 2 iso 0 dist 9.99156 5.38701 9.17462 8.18085 4.32771 5.75959 numMergedOcc 0
18 mol 148 unq 3 iso 0 dist 9.99156 5.38701 9.17462 10.4289 5.84014 6.6946 numMergedOcc 0
19 mol 148 unq 4 iso 0 dist 6.22055 4.73245 5.75959 9.91993 4.32771 9.17462 numMergedOcc 0
20 mol 148 unq 5 iso 0 dist 6.22055 4.73245 5.75959 9.33629 4.26306 6.6946 numMergedOcc 0
21 mol 148 unq 6 iso 0 dist 8.18085 5.38701 5.75959 9.99156 4.32771 9.17462 numMergedOcc 0
22 mol 148 unq 7 iso 0 dist 8.18085 5.38701 5.75959 10.4289 4.26306 6.6946 numMergedOcc 0
23 mol 150 unq 0 iso 0 dist 9.96691 4.73768 9.01668 6.14675 4.39943 5.4798 numMergedOcc 0
24 mol 150 unq 1 iso 0 dist 9.96691 4.73768 9.01668 9.24244 5.93611 6.32391 numMergedOcc 0
25 mol 150 unq 2 iso 0 dist 9.8656 5.46333 9.01668 7.94889 4.39943 5.4798 numMergedOcc 0
26 mol 150 unq 3 iso 0 dist 9.8656 5.46333 9.01668 10.2188 5.93611 6.32391 numMergedOcc 0
27 mol 150 unq 4 iso 0 dist 6.14675 4.73768 5.4798 9.96691 4.39943 9.01668 numMergedOcc 0
28 mol 150 unq 5 iso 0 dist 6.14675 4.73768 5.4798 9.24244 4.30207 6.32391 numMergedOcc 0
29 mol 150 unq 6 iso 0 dist 7.94889 5.46333 5.4798 9.8656 4.39943 9.01668 numMergedOcc 0
30 mol 150 unq 7 iso 0 dist 7.94889 5.46333 5.4798 10.2188 4.30207 6.32391 numMergedOcc 0
31 mol 150 unq 8 iso 0 dist 9.24244 4.73768 6.32391 9.96691 5.93611 9.01668 numMergedOcc 0
32 mol 150 unq 9 iso 0 dist 9.24244 4.73768 6.32391 6.14675 4.30207 5.4798 numMergedOcc 0
33 mol 188 unq 0 iso 0 dist 7.14503 8.02684 8.34477 8.10214 9.01338 8.4784 numMergedOcc 0
34 mol 188 unq 1 iso 0 dist 8.10214 8.02684 8.4784 7.14503 9.01338 8.34477 numMergedOcc 0
35 mol 205 unq 0 iso 0 dist 6.03688 6.49049 5.59832 9.53629 12.0318 9.17562 numMergedOcc 0
36 mol 222 unq 0 iso 0 dist 9.07471 6.70898 9.30639 9.8062 6.85131 6.24462 numMergedOcc 0
37 mol 222 unq 1 iso 0 dist 9.07471 6.70898 9.30639 10.6381 6.76935 6.02034 numMergedOcc 0
38 mol 278 unq 0 iso 0 dist 8.00673 13.7796 8.1769 23.1285 17.0344 9.9444 numMergedOcc 0
39 mol 278 unq 1 iso 0 dist 6.62841 9.26354 8.1769 19.1325 17.0344 9.9444 numMergedOcc 0
