0 mol 8 unq 0 iso 0 dist 6.92865 9.95165 5.02333 6.88402 8.99126 8.94096 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.84393 8.75332 6.49317 6.31174 8.73972 13.0522 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.85331 4.61828 6.00575 8.91397 9.75144 8.62284 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 5.36645 7.31914 7.34452 4.16088 8.09058 10.8632 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 8.24121 8.26633 4.85355 6.51655 7.04352 9.52877 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 8.24121 8.26633 4.85355 15.9496 8.1114 8.82738 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.22376 9.924 10.121 13.0379 7.22293 16.0288 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 6.30103 6.97288 4.24513 9.81259 7.06013 9.28578 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.56867 8.99731 7.3094 7.97477 6.99777 9.9928 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 9.56867 8.99731 7.3094 6.58038 9.14376 9.68845 numMergedOcc 0
10 mol 124 unq 0 iso 0 dist 7.23052 4.83761 9.70339 10.5562 6.83051 14.76 numMergedOcc 0
11 mol 124 unq 1 iso 0 dist 7.23052 4.83761 9.70339 12.5603 9.28376 16.8279 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 9.05626 4.85559 5.97111 5.53247 6.89257 6.42785 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 9.05626 4.85559 5.97111 8.63186 8.74308 10.3718 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 9.40003 6.40445 15.2 13.377 6.97182 19.719 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 9.40003 6.40445 15.2 9.36638 6.1175 15.6758 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 6.75833 7.10236 8.0904 5.58412 4.87541 10.7365 numMergedOcc 0
17 mol 240 unq 0 iso 0 dist 6.83069 9.30056 10.6074 10.6805 6.15305 15.1106 numMergedOcc 0
18 mol 240 unq 1 iso 0 dist 6.83069 9.30056 10.6074 5.79056 8.0951 14.5055 numMergedOcc 0
19 mol 240 unq 2 iso 0 dist 9.30995 9.30056 9.23135 10.6805 7.03489 15.1106 numMergedOcc 0
20 mol 250 unq 0 iso 0 dist 8.21206 9.48115 15.2098 11.1994 8.80086 20.074 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 7.72749 7.25797 7.26083 13.5492 9.02188 14.1049 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 4.78812 7.11691 8.7909 6.99865 6.73206 11.7075 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 6.62923 7.11691 4.86504 6.99865 9.09992 11.7075 numMergedOcc 0
24 mol 272 unq 2 iso 0 dist 6.62923 7.11691 4.86504 10.3424 6.16449 7.55161 numMergedOcc 0
25 mol 276 unq 0 iso 0 dist 5.30976 8.18672 4.32691 10.4141 8.76347 12.2699 numMergedOcc 0
26 mol 284 unq 0 iso 0 dist 6.86342 9.12227 7.09757 5.13259 7.52785 7.94959 numMergedOcc 0
27 mol 284 unq 1 iso 0 dist 8.08993 5.68818 6.4399 9.65436 8.41504 8.27054 numMergedOcc 0
28 mol 284 unq 2 iso 0 dist 7.34344 5.68818 13.016 5.83318 4.86729 10.7233 numMergedOcc 0
