0 mol 1 unq 0 iso 0 dist 7.81034 7.90928 9.57393 5.06184 10.3005 5.96833 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.19497 7.90928 12.4382 5.06184 13.546 5.96833 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.2228 7.09641 4.51374 7.69571 13.9828 9.92638 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 8.39857 5.70192 4.50024 3.77705 10.3748 8.96498 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 8.39857 5.70192 4.50024 11.7466 10.5286 7.5228 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.33989 8.6411 5.70125 6.69911 6.55112 9.40363 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.57953 8.94956 5.70125 3.94216 6.55112 9.40363 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 8.12903 9.4909 9.82939 11.0011 14.3721 5.47706 numMergedOcc 0
8 mol 78 unq 1 iso 0 dist 8.12903 9.4909 9.82939 10.0477 12.8028 8.89842 numMergedOcc 0
9 mol 78 unq 2 iso 0 dist 8.12903 9.4909 9.82939 16.0481 16.9355 8.07568 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 9.25488 8.02593 8.59213 5.05961 9.33787 5.36254 numMergedOcc 0
11 mol 155 unq 1 iso 0 dist 8.02356 8.02593 6.6805 5.05961 8.99128 5.36254 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 6.60418 9.56248 13.5257 15.8873 16.9011 8.62366 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 6.60418 9.56248 13.5257 14.9274 16.5548 9.44973 numMergedOcc 0
14 mol 173 unq 2 iso 0 dist 6.60418 9.56248 13.5257 9.35913 10.3813 6.52508 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 8.57666 9.00025 16.553 4.6563 12.3171 9.65629 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 5.13534 5.83596 5.20775 11.195 13.6955 9.09234 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 5.13534 5.83596 5.20775 4.76079 5.97971 6.76746 numMergedOcc 0
18 mol 181 unq 2 iso 0 dist 5.13534 5.83596 5.20775 6.38851 9.30874 8.92098 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.44671 7.83363 13.091 4.98419 14.3797 8.24424 numMergedOcc 0
20 mol 233 unq 1 iso 0 dist 9.44671 7.83363 13.091 7.08719 16.0531 7.0942 numMergedOcc 0
21 mol 233 unq 2 iso 0 dist 9.44671 7.83363 13.091 10.7478 17.8847 6.01775 numMergedOcc 0
22 mol 233 unq 3 iso 0 dist 7.21531 7.83363 10.3247 4.98419 9.31086 8.24424 numMergedOcc 0
23 mol 233 unq 4 iso 0 dist 7.21531 7.83363 10.3247 7.08719 11.9113 7.0942 numMergedOcc 0
24 mol 233 unq 5 iso 0 dist 7.21531 7.83363 10.3247 10.7478 11.6346 6.01775 numMergedOcc 0
25 mol 234 unq 0 iso 0 dist 9.63004 7.19662 9.76461 5.99784 12.1171 6.86569 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 7.12027 9.94175 5.2394 10.2069 11.3198 9.38131 numMergedOcc 0
27 mol 239 unq 0 iso 0 dist 4.53228 5.66792 4.74711 11.2891 13.4681 9.74902 numMergedOcc 0
28 mol 245 unq 0 iso 0 dist 9.59668 8.48687 8.41322 10.5397 11.4734 9.43713 numMergedOcc 0
29 mol 273 unq 0 iso 0 dist 6.91029 9.79283 6.72596 12.2057 11.7246 9.35749 numMergedOcc 0
