0 mol 8 unq 0 iso 0 dist 5.38703 7.46102 7.36147 8.25051 12.5407 8.96553 4.81384 8.79697 8.33604 8.27181 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.67455 9.7522 5.71065 15.0931 13.7149 8.34347 11.7823 10.5415 6.73162 7.23546 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.82294 8.99491 5.9853 4.96726 9.21546 9.67592 6.84612 5.1488 8.68586 5.3948 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 9.01568 6.95595 4.95201 12.7957 10.8219 7.79912 8.91765 9.24433 5.15851 10.0425 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 9.01568 6.95595 4.95201 10.309 11.2569 8.56639 8.91765 9.24433 5.15851 11.8774 numMergedOcc 0
5 mol 75 unq 2 iso 0 dist 9.01568 6.95595 4.95201 5.80162 12.2335 8.59017 8.91765 9.24433 5.15851 10.0372 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.41861 6.4551 10.6009 8.78063 14.6364 6.97941 13.2281 16.993 9.49449 6.06861 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 8.87089 7.74197 14.8536 4.0486 11.3747 9.36773 10.0278 16.2116 8.66514 8.4283 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 8.87089 7.74197 14.8536 4.0486 11.3747 9.36773 8.37153 15.7907 9.25235 5.37521 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.73946 5.02717 4.75197 5.28901 9.26923 7.30858 9.81097 12.6726 8.66155 11.3902 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 5.73946 5.02717 4.75197 6.75472 7.9258 5.83991 9.81097 12.6726 8.66155 6.09023 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 5.73946 5.02717 4.75197 11.0268 12.4685 7.88312 9.81097 12.6726 8.66155 4.61908 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 5.74058 5.49877 5.21262 3.96103 9.0918 8.70949 6.53156 9.9263 6.89257 8.84655 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 5.74058 5.49877 5.21262 3.96103 9.0918 8.70949 4.72188 8.28884 8.74308 6.76754 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 8.39553 8.90987 5.03564 5.26654 10.4172 8.03456 14.3961 11.0934 7.17676 11.8759 numMergedOcc 0
15 mol 236 unq 1 iso 0 dist 8.39553 8.90987 5.03564 5.26654 10.4172 8.03456 12.7435 11.5406 6.68463 9.07822 numMergedOcc 0
16 mol 236 unq 2 iso 0 dist 8.39553 8.90987 5.03564 3.82437 6.61371 6.84306 14.3961 11.0934 7.17676 11.3552 numMergedOcc 0
17 mol 236 unq 3 iso 0 dist 8.39553 8.90987 5.03564 3.82437 6.61371 6.84306 12.7435 11.5406 6.68463 11.6837 numMergedOcc 0
18 mol 236 unq 4 iso 0 dist 8.39553 8.90987 5.03564 13.8124 14.1598 9.99038 14.3961 11.0934 7.17676 6.04825 numMergedOcc 0
19 mol 236 unq 5 iso 0 dist 8.39553 8.90987 5.03564 13.8124 14.1598 9.99038 12.7435 11.5406 6.68463 8.8265 numMergedOcc 0
20 mol 236 unq 6 iso 0 dist 8.39553 8.90987 5.03564 11.2846 13.7045 9.78037 14.3961 11.0934 7.17676 12.6468 numMergedOcc 0
21 mol 236 unq 7 iso 0 dist 8.39553 8.90987 5.03564 11.2846 13.7045 9.78037 12.7435 11.5406 6.68463 5.80136 numMergedOcc 0
22 mol 236 unq 8 iso 0 dist 8.39553 8.90987 5.03564 16.8883 12.4813 8.35971 14.3961 11.0934 7.17676 6.40312 numMergedOcc 0
23 mol 236 unq 9 iso 0 dist 8.39553 8.90987 5.03564 16.8883 12.4813 8.35971 12.7435 11.5406 6.68463 6.2568 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 5.83514 9.66555 10.3683 12.2428 14.2408 6.22714 8.92175 10.8592 7.49471 5.17471 numMergedOcc 0
25 mol 256 unq 0 iso 0 dist 9.99628 7.67598 4.85574 8.99993 12.7898 8.29103 9.40096 9.92048 5.24676 4.22352 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 8.93518 6.42725 9.50515 8.70769 13.8546 5.30224 7.53102 15.0482 6.77938 4.99891 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 8.93518 6.42725 9.50515 8.70769 13.8546 5.30224 6.58569 13.3209 7.76676 5.32839 numMergedOcc 0
28 mol 265 unq 0 iso 0 dist 9.94957 9.772 17.2234 5.75478 15.5997 8.4218 5.55314 13.6395 6.34034 6.43013 numMergedOcc 0
