0 mol 71 unq 0 iso 0 dist 8.72396 4.16657 4.87767 11.7213 9.97154 9.50724 numMergedOcc 0
1 mol 71 unq 1 iso 0 dist 8.72396 4.16657 4.87767 10.0189 6.65519 7.87671 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 5.60664 12.0868 7.61405 11.1411 5.76533 6.86463 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.90417 4.39945 8.21723 7.15006 4.19771 5.09725 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 8.7424 7.49807 5.8785 10.1545 5.66517 5.85783 numMergedOcc 0
5 mol 132 unq 0 iso 0 dist 9.0788 4.5649 7.79845 6.13054 13.8244 9.57415 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 9.58272 7.95074 7.26891 7.16289 5.21599 9.17333 numMergedOcc 0
7 mol 154 unq 1 iso 0 dist 5.67578 4.57254 7.26891 9.3164 5.21599 9.17333 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 9.43816 14.0181 9.4588 11.8065 4.98693 8.41494 numMergedOcc 0
9 mol 192 unq 0 iso 0 dist 6.04508 4.14391 7.6168 9.41747 9.81428 6.55345 numMergedOcc 0
10 mol 192 unq 1 iso 0 dist 6.73104 4.14391 4.95155 9.41747 6.38465 6.55345 numMergedOcc 0
11 mol 209 unq 0 iso 0 dist 8.93728 6.57973 8.50624 13.9721 7.9224 9.23866 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 6.44327 6.92811 5.1498 5.15585 6.30987 7.10646 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 8.30526 4.8681 5.1498 11.7682 6.30987 7.10646 numMergedOcc 0
14 mol 232 unq 0 iso 0 dist 7.38809 9.71446 9.65375 15.5319 16.2008 8.24059 numMergedOcc 0
15 mol 234 unq 0 iso 0 dist 9.79506 5.72206 7.37405 8.70264 4.78629 9.24896 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 6.82161 11.273 8.42116 17.3875 14.3962 7.86554 numMergedOcc 0
17 mol 257 unq 1 iso 0 dist 6.82161 8.30954 8.53984 10.4069 12.026 8.5835 numMergedOcc 0
18 mol 257 unq 2 iso 0 dist 5.97154 11.5483 8.42116 18.7401 14.3962 7.86554 numMergedOcc 0
19 mol 257 unq 3 iso 0 dist 5.97154 11.5492 8.53984 17.2115 12.026 8.5835 numMergedOcc 0
20 mol 257 unq 4 iso 0 dist 8.4903 16.1477 8.42116 22.5078 14.3962 7.86554 numMergedOcc 0
21 mol 257 unq 5 iso 0 dist 8.4903 16.1125 8.53984 19.8582 12.026 8.5835 numMergedOcc 0
22 mol 257 unq 6 iso 0 dist 8.04644 14.1389 8.42116 20.1364 14.3962 7.86554 numMergedOcc 0
23 mol 257 unq 7 iso 0 dist 8.04644 15.3553 8.53984 20.0534 12.026 8.5835 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 6.09059 9.52861 8.87598 10.1208 9.33289 5.80603 numMergedOcc 0
25 mol 265 unq 0 iso 0 dist 9.09835 5.74413 5.81967 13.0666 8.32576 8.54733 numMergedOcc 0
26 mol 284 unq 0 iso 0 dist 9.5276 4.29335 8.45487 5.84481 11.6996 9.91812 numMergedOcc 0
