0 mol 1 unq 0 iso 0 dist 6.4181 5.06184 6.86701 7.90928 5.11735 5.96833 9.99706 11.3766 5.21705 9.44115 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 9.46247 3.77705 8.3733 5.70192 10.331 8.96498 5.32316 14.1308 7.64337 7.65646 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 9.71952 6.69911 8.13108 8.6411 7.18506 9.40363 3.94577 7.28257 3.94216 8.94956 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.28257 3.94216 8.13108 8.94956 7.18506 9.40363 3.94577 9.71952 6.69911 8.6411 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.10981 9.89481 8.65848 10.1762 5.22036 5.47706 7.39248 11.0261 11.0011 9.4909 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.10981 9.89481 8.65848 10.1762 5.22036 5.47706 13.4601 13.9595 7.72904 9.15288 numMergedOcc 0
6 mol 78 unq 2 iso 0 dist 9.10981 3.89733 7.25801 10.1762 5.22036 8.89842 7.39248 11.0261 10.0477 9.4909 numMergedOcc 0
7 mol 78 unq 3 iso 0 dist 9.10981 3.89733 7.25801 10.1762 5.22036 8.89842 13.4601 13.9595 13.6432 9.15288 numMergedOcc 0
8 mol 78 unq 4 iso 0 dist 9.23023 13.8703 6.85523 13.8574 4.92509 5.47706 23.0476 14.3902 11.0011 9.4909 numMergedOcc 0
9 mol 78 unq 5 iso 0 dist 9.23023 13.8703 6.85523 13.8574 4.92509 5.47706 19.9793 11.7809 7.72904 9.15288 numMergedOcc 0
10 mol 78 unq 6 iso 0 dist 9.23023 11.9719 5.77326 13.8574 4.92509 8.07568 23.0476 14.3902 16.0481 9.4909 numMergedOcc 0
11 mol 78 unq 7 iso 0 dist 9.23023 11.9719 5.77326 13.8574 4.92509 8.07568 19.9793 11.7809 9.64221 9.15288 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 8.90977 9.58747 8.84018 13.2996 4.91401 9.94053 5.70541 6.90827 5.61881 9.58171 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 13.4009 16.7975 9.08536 14.4171 19.6702 11.2265 8.95838 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 6.18763 5.92411 8.95212 13.4009 16.7975 9.08536 21.0407 22.8005 15.453 9.47892 numMergedOcc 0
15 mol 119 unq 2 iso 0 dist 8.44385 5.92411 6.99446 13.4009 7.36192 9.08536 14.4171 13.2232 11.2265 8.95838 numMergedOcc 0
16 mol 119 unq 3 iso 0 dist 8.44385 5.92411 6.99446 13.4009 7.36192 9.08536 21.0407 15.3808 15.453 9.47892 numMergedOcc 0
17 mol 119 unq 4 iso 0 dist 5.63005 5.92411 7.64052 13.4009 10.6679 9.08536 14.4171 13.3689 11.2265 8.95838 numMergedOcc 0
18 mol 119 unq 5 iso 0 dist 5.63005 5.92411 7.64052 13.4009 10.6679 9.08536 21.0407 19.5006 15.453 9.47892 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 8.30654 9.60065 7.36975 11.674 6.01455 7.05845 12.2173 11.9443 5.36037 9.43335 numMergedOcc 0
20 mol 143 unq 1 iso 0 dist 8.30654 9.60065 7.36975 11.674 6.01455 7.05845 15.1354 13.375 15.3503 9.9492 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.84952 7.19461 6.64173 6.17129 6.7991 9.09234 6.7732 10.8641 11.195 5.83596 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 9.84952 9.77747 9.01624 6.17129 6.7991 6.76746 6.7732 10.8641 4.76079 5.83596 numMergedOcc 0
23 mol 181 unq 2 iso 0 dist 9.84952 10.0615 9.55105 6.17129 6.7991 8.92098 6.7732 10.8641 6.38851 5.83596 numMergedOcc 0
24 mol 181 unq 3 iso 0 dist 7.41378 4.76079 5.05973 5.83596 8.35755 6.76746 6.7732 13.0935 9.77747 6.17129 numMergedOcc 0
25 mol 197 unq 0 iso 0 dist 8.3337 17.2264 9.10817 10.7619 5.2908 9.27218 15.1486 13.2177 15.7632 8.32685 numMergedOcc 0
26 mol 197 unq 1 iso 0 dist 8.3337 17.2264 9.10817 10.7619 5.2908 9.27218 12.2829 10.9337 15.6628 6.74777 numMergedOcc 0
27 mol 197 unq 2 iso 0 dist 8.3337 17.2264 9.10817 10.7619 5.2908 9.27218 10.6986 12.045 18.7224 9.62514 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 9.54857 5.49348 5.85442 10.5864 5.79468 6.23661 18.3822 11.6963 12.9171 9.53092 numMergedOcc 0
29 mol 259 unq 1 iso 0 dist 6.42725 11.761 8.03219 8.65525 5.31048 8.84648 17.4989 12.9189 9.92544 9.53092 numMergedOcc 0
30 mol 259 unq 2 iso 0 dist 6.42725 6.09466 6.9899 8.65525 5.31048 6.23661 17.4989 12.9189 12.9171 9.53092 numMergedOcc 0
