0 mol 2 unq 0 iso 0 dist 9.9335 6.38677 7.37296 11.5499 5.40651 8.5163 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.9335 6.38677 7.37296 11.3616 10.2334 9.40823 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.8592 7.91041 9.67498 5.62316 5.46848 9.71959 numMergedOcc 0
3 mol 14 unq 0 iso 0 dist 6.3453 5.64699 8.19687 8.74842 4.49408 9.60834 numMergedOcc 0
4 mol 14 unq 1 iso 0 dist 6.3453 7.37113 5.71901 8.74842 4.49408 9.11167 numMergedOcc 0
5 mol 14 unq 2 iso 0 dist 7.98958 6.97821 8.19687 11.9441 4.49408 9.60834 numMergedOcc 0
6 mol 14 unq 3 iso 0 dist 7.98958 4.80565 5.71901 11.9441 4.49408 9.11167 numMergedOcc 0
7 mol 55 unq 0 iso 0 dist 5.29239 6.19827 7.58788 13.1848 11.7434 7.62977 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 5.8915 8.5691 7.81042 9.17671 5.56761 9.0807 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 7.03253 6.87055 7.47653 10.404 4.61946 8.25442 numMergedOcc 0
10 mol 130 unq 1 iso 0 dist 7.03253 6.09126 8.97124 10.404 4.61946 9.57695 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 7.47105 10.6706 7.50126 12.3974 6.53637 4.84604 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 6.4413 13.2694 9.71692 21.4826 16.8544 8.63766 numMergedOcc 0
13 mol 150 unq 0 iso 0 dist 6.62609 13.3379 9.73708 21.6656 16.9387 8.7107 numMergedOcc 0
14 mol 151 unq 0 iso 0 dist 8.54771 4.76145 8.40442 11.5348 12.7974 8.20292 numMergedOcc 0
15 mol 199 unq 0 iso 0 dist 7.22303 5.56055 9.88917 12.9774 14.6089 7.91016 numMergedOcc 0
16 mol 199 unq 1 iso 0 dist 7.22303 5.56055 9.88917 11.5612 11.6262 7.21813 numMergedOcc 0
17 mol 199 unq 2 iso 0 dist 7.22303 10.5991 9.56785 11.5612 11.6262 9.74632 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 9.37257 5.8741 9.68829 9.6897 10.8277 9.10711 numMergedOcc 0
19 mol 226 unq 0 iso 0 dist 6.3687 12.3798 7.20862 10.0563 5.84124 9.29519 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 7.16232 10.121 9.174 10.2231 7.14491 8.99792 numMergedOcc 0
