0 mol 20 unq 0 iso 0 dist 8.91904 6.18007 5.86761 3.89371 8.89154 7.6974 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.67926 7.63824 10.9551 10.9159 17.4913 7.79911 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 6.22956 8.39335 10.0772 12.3044 15.4473 6.73466 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.51587 8.39335 8.43579 12.3044 13.943 6.73466 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.44186 6.35305 7.41773 10.1005 13.5703 7.29864 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 7.44186 6.35305 7.41773 4.01477 6.59382 6.04223 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 5.38954 5.94465 5.11935 8.64874 6.81489 6.01857 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 7.7267 8.42277 8.17376 8.62597 11.2089 7.93106 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 7.7267 8.42277 8.17376 4.04119 9.62396 7.04904 numMergedOcc 0
9 mol 129 unq 2 iso 0 dist 7.7267 6.26653 6.47582 8.62597 11.2089 9.05575 numMergedOcc 0
10 mol 129 unq 3 iso 0 dist 7.7267 6.26653 6.47582 4.04119 9.62396 5.06053 numMergedOcc 0
11 mol 151 unq 0 iso 0 dist 8.96469 5.91643 4.17025 4.85702 12.1171 9.98086 numMergedOcc 0
12 mol 151 unq 1 iso 0 dist 8.96469 5.91643 4.17025 4.18174 12.2405 8.89982 numMergedOcc 0
13 mol 151 unq 2 iso 0 dist 8.96469 5.91643 4.17025 4.20596 9.74969 6.12972 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 7.26891 8.50487 4.8443 4.05045 7.31277 8.26128 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 9.20346 8.60009 6.6815 11.8032 12.3249 8.07469 numMergedOcc 0
16 mol 196 unq 0 iso 0 dist 8.62618 8.32524 6.74969 12.0229 11.6816 8.3151 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 8.14413 8.20259 5.30972 4.04112 9.97171 9.49242 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 9.98753 6.23243 10.6705 4.12315 12.7157 7.45831 numMergedOcc 0
19 mol 233 unq 0 iso 0 dist 9.99681 6.45095 12.9722 3.63541 11.8093 7.40498 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 5.69868 5.91094 6.94281 4.11602 8.58481 8.37701 numMergedOcc 0
21 mol 239 unq 1 iso 0 dist 7.90449 7.45508 14.793 9.19611 12.4432 8.53092 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 7.80528 8.46816 7.04725 3.9734 11.4378 9.93669 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 7.42888 4.98907 8.9947 3.89286 10.3095 6.61322 numMergedOcc 0
24 mol 280 unq 0 iso 0 dist 8.51073 8.6212 3.76721 4.79056 7.10723 9.22665 numMergedOcc 0
25 mol 280 unq 1 iso 0 dist 8.51073 8.6212 3.76721 12.0649 6.8664 9.84708 numMergedOcc 0
26 mol 280 unq 2 iso 0 dist 6.30852 8.6212 8.33181 4.79056 8.01368 9.22665 numMergedOcc 0
27 mol 280 unq 3 iso 0 dist 6.30852 8.6212 8.33181 12.0649 15.1358 9.84708 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 7.71392 8.81999 12.2834 8.9836 11.3832 9.64969 numMergedOcc 0
29 mol 294 unq 1 iso 0 dist 7.71392 5.18334 5.71856 11.4279 10.7501 7.48987 numMergedOcc 0
30 mol 294 unq 2 iso 0 dist 6.6112 6.44588 5.71856 9.32276 10.7501 7.48987 numMergedOcc 0
31 mol 294 unq 3 iso 0 dist 5.02677 8.81999 5.33113 8.9836 6.42303 9.64969 numMergedOcc 0
32 mol 294 unq 4 iso 0 dist 5.02677 5.18334 8.52592 11.4279 15.4564 7.48987 numMergedOcc 0
33 mol 294 unq 5 iso 0 dist 8.34193 6.44588 8.52592 9.32276 15.4564 7.48987 numMergedOcc 0
34 mol 294 unq 6 iso 0 dist 7.6859 8.81999 15.8342 8.9836 15.97 9.64969 numMergedOcc 0
35 mol 294 unq 7 iso 0 dist 7.6859 5.18334 4.99494 11.4279 5.27236 7.48987 numMergedOcc 0
36 mol 294 unq 8 iso 0 dist 8.35722 6.44588 4.99494 9.32276 5.27236 7.48987 numMergedOcc 0
