0 mol 48 unq 0 iso 0 dist 7.55854 5.37112 9.14072 7.49678 9.90363 5.06188 numMergedOcc 0
1 mol 48 unq 1 iso 0 dist 5.48669 8.94459 9.14072 11.6001 9.90363 5.06188 numMergedOcc 0
2 mol 48 unq 2 iso 0 dist 5.78051 9.49743 9.14072 12.726 9.90363 5.06188 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.07638 4.49648 8.73093 7.37476 12.3943 7.48556 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.07638 4.50556 9.1622 10.8557 17.0484 8.07498 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.07638 4.50556 9.1622 7.37476 12.3943 9.47045 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 6.79787 4.49648 8.02104 7.37476 9.57143 7.48556 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 6.79787 4.50556 7.59013 10.8557 14.8028 8.07498 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 6.79787 4.50556 7.59013 7.37476 9.57143 9.47045 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 9.0101 4.77004 7.41861 7.52544 7.7047 5.73235 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 9.0101 4.77004 7.41861 8.08674 4.00834 7.48127 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 5.99873 5.64342 8.79677 11.4105 11.5575 6.54778 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 5.99873 5.64342 8.79677 8.80616 4.66388 8.57909 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 9.07222 9.67626 9.62357 16.1853 15.1223 6.61973 numMergedOcc 0
14 mol 128 unq 0 iso 0 dist 9.20442 5.54195 8.83811 13.8468 12.0212 8.64054 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 4.76012 7.37866 5.16531 16.2647 12.2874 9.52061 numMergedOcc 0
16 mol 136 unq 0 iso 0 dist 9.16075 4.36978 7.65792 11.6493 4.65485 8.41727 numMergedOcc 0
17 mol 147 unq 0 iso 0 dist 8.94007 12.2068 5.47265 16.3565 7.75436 5.32865 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 9.2621 6.16238 9.05865 13.3944 9.56212 8.10386 numMergedOcc 0
19 mol 192 unq 0 iso 0 dist 7.83389 6.22575 5.21088 11.3263 4.65303 7.36571 numMergedOcc 0
20 mol 192 unq 1 iso 0 dist 7.83389 14.4767 9.78743 16.6194 13.2525 6.2016 numMergedOcc 0
21 mol 192 unq 2 iso 0 dist 7.83389 6.95862 8.25609 11.3263 4.65303 9.17137 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 9.78043 10.9934 9.35664 15.0223 10.612 7.2833 numMergedOcc 0
23 mol 230 unq 0 iso 0 dist 6.97966 4.59722 5.19913 11.3096 6.28086 9.24729 numMergedOcc 0
24 mol 233 unq 0 iso 0 dist 7.09902 9.3685 8.01777 15.0309 12.4724 6.9103 numMergedOcc 0
25 mol 233 unq 1 iso 0 dist 8.73545 4.67806 8.01777 9.06221 12.4724 6.9103 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 9.44043 11.1283 5.9223 16.1106 10.1932 7.53199 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 9.44043 11.1283 5.9223 9.27225 9.26732 8.58092 numMergedOcc 0
28 mol 258 unq 2 iso 0 dist 9.44043 11.1283 5.9223 12.0657 6.72414 7.40014 numMergedOcc 0
29 mol 258 unq 3 iso 0 dist 5.3435 11.1483 5.9223 14.3822 10.1932 7.53199 numMergedOcc 0
30 mol 258 unq 4 iso 0 dist 5.3435 11.1483 5.9223 13.3962 9.26732 8.58092 numMergedOcc 0
31 mol 258 unq 5 iso 0 dist 5.3435 11.1483 5.9223 10.2911 6.72414 7.40014 numMergedOcc 0
32 mol 258 unq 6 iso 0 dist 8.28364 13.5253 5.9223 18.2707 10.1932 7.53199 numMergedOcc 0
33 mol 258 unq 7 iso 0 dist 8.28364 13.5253 5.9223 16.3819 9.26732 8.58092 numMergedOcc 0
34 mol 258 unq 8 iso 0 dist 8.28364 13.5253 5.9223 14.3118 6.72414 7.40014 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 5.83023 4.69901 8.99435 9.96121 9.74634 8.04712 numMergedOcc 0
