0 mol 7 unq 0 iso 0 dist 6.22892 5.13744 6.36911 12.0214 10.2446 7.45262 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.22892 5.13744 6.36911 11.7931 12.3097 6.96586 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.92865 6.88402 8.99126 9.95165 5.02333 8.94096 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 9.47321 8.48796 8.47421 12.2499 3.98483 8.04924 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 9.4523 13.8846 9.87449 16.2362 7.51034 8.22285 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.85331 8.91397 9.75144 4.61828 6.00575 8.62284 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 8.24121 6.51655 7.04352 8.26633 4.85355 9.52877 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 8.24121 15.9496 8.1114 8.26633 4.85355 8.82738 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.22376 13.0379 7.22293 13.7303 8.42713 8.87194 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 6.30103 9.81259 7.06013 6.97288 4.24513 9.28578 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 5.97879 5.84883 6.73814 10.6323 5.6074 8.11094 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 9.56867 7.97477 6.99777 8.99731 7.3094 9.9928 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.85677 11.7378 8.43904 16.9514 10.326 9.87025 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 9.05626 5.53247 6.89257 4.85559 5.97111 6.42785 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 9.05626 5.53247 6.89257 11.415 6.97875 6.82089 numMergedOcc 0
15 mol 130 unq 2 iso 0 dist 9.05626 8.63186 8.74308 11.415 6.97875 5.38314 numMergedOcc 0
16 mol 140 unq 0 iso 0 dist 8.36882 13.9771 8.19104 19.612 11.5685 8.06396 numMergedOcc 0
17 mol 140 unq 1 iso 0 dist 8.36882 13.9771 8.19104 13.7791 8.83949 8.01587 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 9.18691 9.53126 7.7056 17.3093 11.488 8.1582 numMergedOcc 0
19 mol 143 unq 1 iso 0 dist 9.18691 9.53126 7.7056 15.0047 9.53139 7.88655 numMergedOcc 0
20 mol 143 unq 2 iso 0 dist 8.90592 4.85796 7.7056 11.9348 11.488 8.1582 numMergedOcc 0
21 mol 143 unq 3 iso 0 dist 8.90592 4.85796 7.7056 12.6044 9.53139 7.88655 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 8.47248 15.9026 8.60247 13.2913 6.214 5.10114 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 9.88212 13.5954 7.18041 15.2607 5.7776 6.86795 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 9.88212 13.5954 7.18041 13.5148 5.282 6.23898 numMergedOcc 0
25 mol 218 unq 2 iso 0 dist 9.88212 12.7227 7.17547 19.2138 10.3246 9.67381 numMergedOcc 0
26 mol 218 unq 3 iso 0 dist 9.88212 12.7227 7.17547 15.2607 5.7776 6.61099 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 6.62923 10.3424 6.16449 7.11691 4.86504 7.55161 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 6.86342 5.13259 7.52785 9.12227 7.09757 7.94959 numMergedOcc 0
29 mol 284 unq 1 iso 0 dist 9.41428 5.90634 8.41504 12.6383 6.4399 8.27054 numMergedOcc 0
30 mol 284 unq 2 iso 0 dist 7.32482 9.91995 8.41504 11.8566 6.4399 8.27054 numMergedOcc 0
31 mol 284 unq 3 iso 0 dist 8.08993 9.65436 8.41504 5.68818 6.4399 8.27054 numMergedOcc 0
