0 mol 0 unq 0 iso 0 dist 6.99594 14.1874 8.31596 3.68241 5.75315 11.6716 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.99594 7.65884 6.3267 3.68241 5.75315 6.78129 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.77049 6.67398 7.2199 9.99243 9.81658 3.91075 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.77049 10.8637 6.9513 9.99243 9.81658 8.25089 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 8.77049 15.8678 9.16116 9.99243 9.81658 12.0874 numMergedOcc 0
5 mol 9 unq 3 iso 0 dist 8.77049 6.08055 8.47109 9.99243 9.81658 14.6279 numMergedOcc 0
6 mol 9 unq 4 iso 0 dist 6.95341 9.03359 7.2199 12.0088 9.81658 3.91075 numMergedOcc 0
7 mol 9 unq 5 iso 0 dist 6.95341 12.1945 6.9513 12.0088 9.81658 8.25089 numMergedOcc 0
8 mol 9 unq 6 iso 0 dist 6.95341 15.8801 9.16116 12.0088 9.81658 12.0874 numMergedOcc 0
9 mol 9 unq 7 iso 0 dist 6.95341 4.46001 8.47109 12.0088 9.81658 14.6279 numMergedOcc 0
10 mol 32 unq 0 iso 0 dist 7.88576 10.3796 7.18766 5.78495 7.11053 5.19476 numMergedOcc 0
11 mol 32 unq 1 iso 0 dist 7.88576 10.2167 7.48825 5.78495 7.11053 8.73368 numMergedOcc 0
12 mol 88 unq 0 iso 0 dist 6.98838 7.10144 7.71582 7.32542 5.28732 6.67934 numMergedOcc 0
13 mol 88 unq 1 iso 0 dist 6.98838 9.32959 6.65776 7.32542 5.28732 4.39545 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 5.58063 10.3316 6.40036 8.29196 7.65255 5.78043 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 8.02593 5.92486 7.37901 5.05961 5.36254 4.48516 numMergedOcc 0
16 mol 155 unq 1 iso 0 dist 8.77391 9.36845 7.37901 5.68679 5.36254 4.48516 numMergedOcc 0
17 mol 173 unq 0 iso 0 dist 9.56248 18.0449 9.79554 15.8873 8.62366 12.9142 numMergedOcc 0
18 mol 173 unq 1 iso 0 dist 9.56248 18.0449 9.79554 14.9274 9.44973 12.5859 numMergedOcc 0
19 mol 173 unq 2 iso 0 dist 9.56248 18.0449 9.79554 9.35913 6.52508 14.5434 numMergedOcc 0
20 mol 175 unq 0 iso 0 dist 9.00025 6.33235 6.74517 4.6563 9.65629 4.01736 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 9.86352 8.39208 5.89018 7.60521 8.66162 4.08137 numMergedOcc 0
22 mol 204 unq 1 iso 0 dist 9.42374 5.43506 5.89018 9.69119 5.3819 9.11693 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 7.90156 10.6875 8.57853 11.2254 8.61306 16.2592 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 7.90156 5.85592 6.75035 11.2254 8.61306 10.1772 numMergedOcc 0
25 mol 227 unq 0 iso 0 dist 8.42382 7.51342 6.152 12.9828 9.8009 5.99236 numMergedOcc 0
26 mol 233 unq 0 iso 0 dist 7.83363 11.8509 9.2911 4.98419 8.24424 9.35904 numMergedOcc 0
27 mol 233 unq 1 iso 0 dist 7.83363 11.8509 9.2911 7.08719 7.0942 5.88701 numMergedOcc 0
28 mol 233 unq 2 iso 0 dist 7.83363 11.8509 9.2911 10.7478 6.01775 9.59241 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 9.46582 14.0686 6.5772 5.17342 7.39547 9.79637 numMergedOcc 0
30 mol 243 unq 0 iso 0 dist 7.77265 7.69259 9.1101 8.61196 9.33476 10.106 numMergedOcc 0
31 mol 270 unq 0 iso 0 dist 8.76013 6.41275 8.39167 12.5153 9.51462 7.66392 numMergedOcc 0
32 mol 270 unq 1 iso 0 dist 8.76013 6.41275 8.39167 6.27469 8.12971 4.66212 numMergedOcc 0
33 mol 270 unq 2 iso 0 dist 8.76013 12.4967 9.17227 12.5153 9.51462 3.98629 numMergedOcc 0
34 mol 270 unq 3 iso 0 dist 8.76013 12.4967 9.17227 6.27469 8.12971 8.41656 numMergedOcc 0
