0 mol 25 unq 0 iso 0 dist 9.95169 4.96681 9.48085 11.6047 8.53931 12.1492 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.95169 12.2441 9.49421 11.6047 8.53931 4.70708 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 8.16985 10.1721 9.74228 5.00053 9.14817 6.00418 numMergedOcc 0
3 mol 72 unq 1 iso 0 dist 8.16985 11.6369 7.12321 5.00053 9.14817 9.0131 numMergedOcc 0
4 mol 72 unq 2 iso 0 dist 8.16985 6.12361 6.21799 5.00053 9.14817 6.11922 numMergedOcc 0
5 mol 72 unq 3 iso 0 dist 7.81344 6.12361 5.03251 5.00053 9.76686 6.11922 numMergedOcc 0
6 mol 72 unq 4 iso 0 dist 7.81344 11.4334 9.56773 5.00053 9.76686 9.93049 numMergedOcc 0
7 mol 72 unq 5 iso 0 dist 7.49245 5.43672 5.03251 9.57455 9.76686 6.11922 numMergedOcc 0
8 mol 72 unq 6 iso 0 dist 7.49245 7.58401 9.56773 9.57455 9.76686 9.93049 numMergedOcc 0
9 mol 72 unq 7 iso 0 dist 5.49421 6.12361 7.66093 5.00053 9.437 6.11922 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 8.8326 15.957 8.13108 9.82998 9.4866 10.963 numMergedOcc 0
11 mol 76 unq 1 iso 0 dist 8.8326 15.957 8.13108 15.7506 9.40363 7.18506 numMergedOcc 0
12 mol 89 unq 0 iso 0 dist 5.10735 4.77072 6.53308 7.54528 9.86405 4.46337 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 6.74197 12.31 9.64383 10.1356 4.44979 12.0058 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 6.74197 11.0642 7.54889 10.1356 4.44979 10.0962 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 6.74197 7.71768 7.78931 10.1356 4.44979 11.2452 numMergedOcc 0
16 mol 112 unq 0 iso 0 dist 7.77418 6.95852 5.56994 10.9659 6.12922 6.35364 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 7.49352 10.5666 5.35237 10.8174 6.57379 8.96357 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 7.49352 14.3463 7.99477 10.8174 6.57379 5.9915 numMergedOcc 0
19 mol 144 unq 0 iso 0 dist 6.03283 10.6591 7.64028 7.47518 9.09684 10.4074 numMergedOcc 0
20 mol 155 unq 0 iso 0 dist 8.14405 7.92939 8.97626 7.441 7.29911 12.8482 numMergedOcc 0
21 mol 155 unq 1 iso 0 dist 8.14405 7.92939 8.97626 6.79302 5.36254 8.27726 numMergedOcc 0
22 mol 168 unq 0 iso 0 dist 5.21801 7.26802 6.02086 5.09374 7.06851 8.67522 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 6.91906 5.68711 7.46481 5.24956 8.70987 6.67959 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 5.88041 13.1803 8.08349 5.56344 5.73591 10.7113 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 5.88041 13.1803 8.08349 7.256 8.55345 11.4491 numMergedOcc 0
26 mol 224 unq 2 iso 0 dist 5.88041 10.3321 9.78218 5.56344 5.73591 11.4252 numMergedOcc 0
27 mol 224 unq 3 iso 0 dist 5.88041 10.3321 9.78218 7.256 8.55345 9.14568 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 9.2885 5.43184 8.03219 5.4536 8.84648 5.31048 numMergedOcc 0
29 mol 267 unq 0 iso 0 dist 9.5358 12.758 8.8293 13.7223 5.08174 7.11419 numMergedOcc 0
30 mol 267 unq 1 iso 0 dist 9.5358 13.5233 7.34981 13.7223 5.08174 6.45566 numMergedOcc 0
31 mol 284 unq 0 iso 0 dist 9.02411 6.5173 9.19921 9.26331 9.69262 9.71439 numMergedOcc 0
32 mol 284 unq 1 iso 0 dist 9.02411 6.535 6.41303 9.26331 9.69262 5.21666 numMergedOcc 0
