0 mol 9 unq 0 iso 0 dist 9.78006 5.60154 8.04924 11.0722 5.55437 6.81435 9.62394 7.28672 9.57198 8.076 numMergedOcc 0
1 mol 115 unq 0 iso 0 dist 5.72642 11.7126 9.9928 7.21418 8.71286 6.03931 12.13 9.18958 5.60389 8.85881 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 7.99857 7.36192 5.85818 4.99056 8.03035 8.96522 14.2293 11.7884 7.26955 16.0882 numMergedOcc 0
3 mol 119 unq 1 iso 0 dist 8.56342 10.6679 5.85818 3.78311 8.03035 8.96522 17.9198 11.7884 7.26955 16.0882 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 8.41611 5.44503 6.40901 10.8441 5.73236 7.12863 9.14266 5.99865 9.30424 6.95372 numMergedOcc 0
5 mol 156 unq 0 iso 0 dist 7.73169 5.07967 7.04913 5.82636 4.9941 6.6213 7.30357 8.40261 7.30946 10.6589 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 6.72641 10.5203 9.59034 8.12143 7.23293 8.37278 7.76163 6.71237 9.84492 12.1418 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 6.26839 15.9311 9.77862 6.66155 5.52678 12.0339 12.4952 7.50057 9.3402 12.6186 numMergedOcc 0
8 mol 194 unq 1 iso 0 dist 6.26839 15.9311 9.77862 5.4499 9.81666 18.7006 12.4952 7.50057 9.3402 15.8032 numMergedOcc 0
9 mol 194 unq 2 iso 0 dist 8.12346 13.7758 9.77862 6.12973 5.52678 12.0339 15.1649 7.50057 9.3402 12.6186 numMergedOcc 0
10 mol 194 unq 3 iso 0 dist 8.12346 13.7758 9.77862 11.0239 9.81666 18.7006 15.1649 7.50057 9.3402 15.8032 numMergedOcc 0
11 mol 194 unq 4 iso 0 dist 8.83356 5.38925 9.77862 13.0333 5.52678 12.0339 6.72379 7.50057 9.3402 12.6186 numMergedOcc 0
12 mol 194 unq 5 iso 0 dist 8.83356 5.38925 9.77862 18.6469 9.81666 18.7006 6.72379 7.50057 9.3402 15.8032 numMergedOcc 0
13 mol 194 unq 6 iso 0 dist 8.2654 14.2415 9.77862 10.1796 5.52678 12.0339 13.2138 7.50057 9.3402 12.6186 numMergedOcc 0
14 mol 194 unq 7 iso 0 dist 8.2654 14.2415 9.77862 13.5457 9.81666 18.7006 13.2138 7.50057 9.3402 15.8032 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 8.87609 5.06326 7.29542 11.5135 6.53728 7.13893 10.281 6.59663 7.73748 8.20162 numMergedOcc 0
16 mol 227 unq 0 iso 0 dist 8.03442 6.43754 7.1372 11.0628 9.56257 5.92529 5.41321 4.59123 7.57454 12.135 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 6.66971 13.0842 9.42618 10.7508 9.89583 18.0054 10.784 6.84212 8.81629 16.4277 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 6.66971 13.0842 9.42618 10.7508 9.89583 18.0054 7.57812 4.77308 6.87131 14.4327 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 6.66971 13.0842 9.42618 10.7508 9.89583 18.0054 8.69104 10.2777 9.69818 18.559 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 6.4398 15.3074 9.42618 5.87253 9.89583 18.0054 12.2731 6.84212 8.81629 16.4277 numMergedOcc 0
21 mol 238 unq 4 iso 0 dist 6.4398 15.3074 9.42618 5.87253 9.89583 18.0054 10.1217 4.77308 6.87131 14.4327 numMergedOcc 0
22 mol 238 unq 5 iso 0 dist 6.4398 15.3074 9.42618 5.87253 9.89583 18.0054 13.492 10.2777 9.69818 18.559 numMergedOcc 0
23 mol 238 unq 6 iso 0 dist 7.32982 8.85181 9.42618 10.7551 9.89583 18.0054 12.6066 6.84212 8.81629 16.4277 numMergedOcc 0
24 mol 238 unq 7 iso 0 dist 7.32982 8.85181 9.42618 10.7551 9.89583 18.0054 9.24557 4.77308 6.87131 14.4327 numMergedOcc 0
25 mol 238 unq 8 iso 0 dist 7.32982 8.85181 9.42618 10.7551 9.89583 18.0054 12.9364 10.2777 9.69818 18.559 numMergedOcc 0
