0 mol 1 unq 0 iso 0 dist 8.40848 12.1307 7.81034 9.02078 6.4181 4.58277 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.40848 10.559 9.19497 9.02078 6.4181 9.98089 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 6.74091 10.2455 9.38983 9.70065 9.07663 4.64543 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 6.30807 12.4266 9.84967 6.67111 5.5814 8.81758 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.65313 11.062 8.6338 8.19638 9.22002 11.2947 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 8.65313 11.062 8.6338 7.43426 7.52103 4.78811 numMergedOcc 0
6 mol 61 unq 2 iso 0 dist 8.65313 9.46692 7.63159 8.19638 9.22002 13.0859 numMergedOcc 0
7 mol 61 unq 3 iso 0 dist 8.65313 9.46692 7.63159 7.43426 7.52103 7.13676 numMergedOcc 0
8 mol 61 unq 4 iso 0 dist 9.00513 6.52096 7.31677 6.63565 8.46556 4.78811 numMergedOcc 0
9 mol 61 unq 5 iso 0 dist 8.64665 9.50418 7.31677 9.0032 8.46556 4.78811 numMergedOcc 0
10 mol 67 unq 0 iso 0 dist 5.16558 4.53097 8.39857 6.27668 9.46247 8.06806 numMergedOcc 0
11 mol 69 unq 0 iso 0 dist 7.17678 8.98413 7.30652 5.08122 5.47319 7.0643 numMergedOcc 0
12 mol 69 unq 1 iso 0 dist 7.17678 8.98413 7.30652 9.69519 9.8809 15.5982 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 9.16344 4.02653 8.3565 7.32041 8.35636 6.66379 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 8.21127 5.73904 5.73946 6.86762 5.02717 4.75197 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 8.87505 4.66619 5.74058 8.50937 5.49877 5.21262 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 9.86691 8.09812 6.9268 4.32516 9.3894 10.2681 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 5.7232 6.14253 9.73038 8.76089 9.50322 5.34829 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 5.7232 6.14253 9.73038 6.80087 5.82404 9.67676 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 9.38623 4.91302 6.28957 7.01116 8.43038 4.70374 numMergedOcc 0
20 mol 173 unq 0 iso 0 dist 7.76856 6.2739 6.60418 11.3653 8.1088 10.2688 numMergedOcc 0
21 mol 176 unq 0 iso 0 dist 8.11904 6.30137 9.32606 10.6861 9.66407 14.4797 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 5.93515 6.35731 5.13534 10.7307 7.41378 4.62576 numMergedOcc 0
23 mol 185 unq 0 iso 0 dist 6.06763 9.15037 8.85182 12.6996 9.878 6.99799 numMergedOcc 0
24 mol 185 unq 1 iso 0 dist 6.06763 3.55732 5.7065 12.6996 9.878 12.6202 numMergedOcc 0
25 mol 226 unq 0 iso 0 dist 7.9801 8.45224 5.71182 12.195 7.117 4.66606 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 4.43243 7.15062 9.51001 5.03598 5.66569 10.5269 numMergedOcc 0
27 mol 244 unq 0 iso 0 dist 7.00974 11.3038 9.06357 9.23493 7.65388 16.3995 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 6.83706 14.6808 8.93518 9.03495 6.42725 9.50515 numMergedOcc 0
29 mol 265 unq 0 iso 0 dist 8.09021 15.4423 9.94957 4.75685 9.772 17.2234 numMergedOcc 0
30 mol 265 unq 1 iso 0 dist 6.98451 11.3503 9.94957 11.5105 9.772 17.2234 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 9.96682 12.5944 7.8547 13.2905 9.09967 4.84546 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 9.96682 12.5944 7.8547 4.68199 8.49076 13.2618 numMergedOcc 0
