0 mol 14 unq 0 iso 0 dist 7.0208 5.1956 5.36937 10.5465 9.58196 6.03847 12.8297 7.95811 8.10957 6.30573 12.1294 5.53425 8.82819 9.7022 4.81121 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 7.0208 5.1956 5.36937 10.5465 9.58196 6.03847 12.8297 7.95811 8.10957 6.30573 9.64431 4.53725 5.99703 9.04767 6.24146 numMergedOcc 0
2 mol 14 unq 2 iso 0 dist 7.28563 6.38279 5.36937 12.3645 9.58196 6.03847 13.4561 7.95811 8.10957 6.30573 12.5485 5.53425 8.82819 9.7022 4.81121 numMergedOcc 0
3 mol 14 unq 3 iso 0 dist 7.28563 6.38279 5.36937 12.3645 9.58196 6.03847 13.4561 7.95811 8.10957 6.30573 8.51112 4.53725 5.99703 9.04767 6.24146 numMergedOcc 0
4 mol 14 unq 4 iso 0 dist 8.51112 10.7867 7.73217 12.3645 9.04767 4.75873 13.4561 6.24146 7.59564 6.30573 12.5485 5.67201 10.9341 9.7022 4.81121 numMergedOcc 0
5 mol 14 unq 5 iso 0 dist 8.51112 10.7867 7.73217 12.3645 9.04767 4.75873 13.4561 6.24146 7.59564 6.30573 7.28563 4.53725 9.95397 9.58196 7.95811 numMergedOcc 0
6 mol 14 unq 6 iso 0 dist 8.51112 6.38279 5.99703 12.3645 9.04767 6.03847 13.4561 6.24146 8.10957 6.30573 12.5485 5.67201 8.82819 9.7022 4.81121 numMergedOcc 0
7 mol 14 unq 7 iso 0 dist 8.51112 6.38279 5.99703 12.3645 9.04767 6.03847 13.4561 6.24146 8.10957 6.30573 7.28563 4.53725 5.36937 9.58196 7.95811 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 8.13365 8.35576 8.0319 10.5449 6.86014 11.4109 8.10063 6.88453 5.85737 13.0211 17.544 10.0952 15.5112 8.86116 16.0093 numMergedOcc 0
9 mol 43 unq 0 iso 0 dist 8.47617 11.3388 8.03754 8.14351 6.20293 13.1056 14.3847 14.9082 8.84944 19.6842 8.99509 5.06502 12.7352 5.73819 18.1465 numMergedOcc 0
10 mol 43 unq 1 iso 0 dist 8.47617 11.3388 8.03754 8.14351 6.20293 13.1056 14.3847 14.9082 8.84944 19.6842 5.73331 6.45462 10.5813 8.93915 13.4248 numMergedOcc 0
11 mol 43 unq 2 iso 0 dist 8.47617 11.3388 8.03754 8.14351 6.20293 13.1056 10.2091 4.80528 7.21995 10.6604 8.99509 5.06502 12.7352 5.73819 7.29214 numMergedOcc 0
12 mol 43 unq 3 iso 0 dist 8.47617 11.3388 8.03754 8.14351 6.20293 13.1056 10.2091 4.80528 7.21995 10.6604 5.73331 6.45462 10.5813 8.93915 6.03631 numMergedOcc 0
13 mol 43 unq 4 iso 0 dist 5.73331 4.09692 9.47348 8.14351 8.93915 9.92508 5.5483 6.9067 7.32913 13.3384 8.99509 5.89973 12.0317 5.73819 12.3867 numMergedOcc 0
14 mol 43 unq 5 iso 0 dist 5.73331 4.09692 9.47348 8.14351 8.93915 9.92508 5.5483 6.9067 7.32913 13.3384 8.47617 6.45462 12.0919 6.20293 12.0037 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 5.11612 5.73904 7.9258 10.3475 9.33865 10.9791 10.879 9.48465 9.33293 16.9836 11.7895 8.02349 12.4685 6.11741 14.7844 numMergedOcc 0
16 mol 115 unq 1 iso 0 dist 5.11612 5.73904 7.9258 6.86762 5.83991 4.75197 10.879 9.48465 9.33293 9.71126 12.9567 10.8507 9.26923 7.30858 7.81993 numMergedOcc 0
17 mol 115 unq 2 iso 0 dist 5.11612 5.73904 7.9258 6.86762 5.83991 4.75197 10.879 9.48465 9.33293 9.71126 11.7895 8.02349 12.4685 7.88312 14.7844 numMergedOcc 0
18 mol 129 unq 0 iso 0 dist 6.47346 11.0685 8.59695 6.90896 5.83384 6.13737 11.2025 5.99695 9.52061 10.482 14.4108 9.05135 11.3703 9.61051 11.2246 numMergedOcc 0
19 mol 129 unq 1 iso 0 dist 6.47346 3.86284 6.42706 6.90896 5.83384 5.12351 10.8239 6.29782 9.61101 10.514 14.4108 9.05135 12.0652 9.61051 8.07347 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 8.94909 6.14253 9.47554 6.80087 8.00618 9.67676 13.8059 17.2988 8.8353 15.7117 12.8006 11.965 15.8406 6.29155 20.8975 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 8.94909 6.14253 9.47554 6.80087 8.00618 9.67676 13.8059 17.2988 8.8353 15.7117 9.73536 7.79672 13.9771 6.80239 21.643 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 9.0847 13.0972 8.41774 8.41711 6.70283 13.793 14.4446 14.069 9.65031 19.3797 9.37459 5.42328 13.7313 5.87555 17.6261 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 9.0847 13.0972 8.41774 8.41711 6.70283 13.793 14.4446 14.069 9.65031 19.3797 6.00061 6.4896 12.3711 8.67331 13.432 numMergedOcc 0
24 mol 152 unq 2 iso 0 dist 9.0847 13.0972 8.41774 8.41711 6.70283 13.793 10.1793 4.46956 8.51844 10.5594 9.37459 5.42328 13.7313 5.87555 7.09604 numMergedOcc 0
25 mol 152 unq 3 iso 0 dist 9.0847 13.0972 8.41774 8.41711 6.70283 13.793 10.1793 4.46956 8.51844 10.5594 6.00061 6.4896 12.3711 8.67331 5.74625 numMergedOcc 0
26 mol 152 unq 4 iso 0 dist 9.0847 13.0972 8.41774 4.82496 7.16148 11.2124 14.4446 14.069 9.65031 15.7694 9.37459 5.42328 13.7313 8.87437 17.6261 numMergedOcc 0
27 mol 152 unq 5 iso 0 dist 9.0847 13.0972 8.41774 4.82496 7.16148 11.2124 14.4446 14.069 9.65031 15.7694 6.00061 6.4896 12.3711 8.05741 13.432 numMergedOcc 0
28 mol 152 unq 6 iso 0 dist 9.0847 13.0972 8.41774 4.82496 7.16148 11.2124 10.1793 4.46956 8.51844 10.166 9.37459 5.42328 13.7313 8.87437 7.09604 numMergedOcc 0
29 mol 152 unq 7 iso 0 dist 9.0847 13.0972 8.41774 4.82496 7.16148 11.2124 10.1793 4.46956 8.51844 10.166 6.00061 6.4896 12.3711 8.05741 5.74625 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 9.61379 8.96279 7.49783 9.57016 8.95269 12.8561 13.0995 6.87755 6.23677 12.2287 11.7326 4.70378 11.5265 6.57273 9.28732 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 9.61379 8.96279 7.49783 9.57016 8.95269 12.8561 13.0995 6.87755 6.23677 12.2287 14.3448 11.5372 14.8623 5.78342 11.9963 numMergedOcc 0
32 mol 224 unq 2 iso 0 dist 9.61379 8.96279 7.49783 9.57016 8.95269 12.8561 17.005 12.3271 9.04741 16.6527 11.7326 4.70378 11.5265 6.57273 14.5624 numMergedOcc 0
33 mol 224 unq 3 iso 0 dist 9.61379 8.96279 7.49783 9.57016 8.95269 12.8561 17.005 12.3271 9.04741 16.6527 14.3448 11.5372 14.8623 5.78342 15.2616 numMergedOcc 0
34 mol 224 unq 4 iso 0 dist 9.61379 8.96279 7.49783 9.57016 8.95269 12.8561 13.0235 11.0252 7.31608 12.7763 11.7326 4.70378 11.5265 6.57273 12.8423 numMergedOcc 0
35 mol 224 unq 5 iso 0 dist 9.61379 8.96279 7.49783 9.57016 8.95269 12.8561 13.0235 11.0252 7.31608 12.7763 14.3448 11.5372 14.8623 5.78342 11.9015 numMergedOcc 0
36 mol 224 unq 6 iso 0 dist 8.47457 5.39078 8.80858 8.1404 6.60589 4.93626 9.99396 16.607 8.8113 13.6975 12.3857 5.0744 10.8126 6.57273 19.3745 numMergedOcc 0
37 mol 224 unq 7 iso 0 dist 8.47457 5.39078 8.80858 15.1783 9.16166 11.8641 9.99396 16.607 8.8113 19.4037 12.3857 5.0744 10.8126 5.78342 19.3745 numMergedOcc 0
38 mol 224 unq 8 iso 0 dist 8.47457 5.39078 8.80858 15.1783 9.16166 11.8641 9.99396 16.607 8.8113 19.4037 14.6947 6.91102 13.3427 5.81334 20.7199 numMergedOcc 0
39 mol 236 unq 0 iso 0 dist 5.99137 7.15062 7.87233 13.7629 9.81562 15.6279 9.80618 7.77821 4.71683 12.96 11.0371 7.28249 9.13551 8.03456 5.27568 numMergedOcc 0
40 mol 236 unq 1 iso 0 dist 5.99137 7.15062 7.87233 13.3575 7.68742 13.7246 9.80618 7.77821 4.71683 10.8312 11.0371 7.28249 9.13551 6.84306 5.27568 numMergedOcc 0
41 mol 236 unq 2 iso 0 dist 5.99137 7.15062 7.87233 5.03598 6.27581 10.5269 9.80618 7.77821 4.71683 11.2195 11.0371 7.28249 9.13551 9.99038 5.27568 numMergedOcc 0
42 mol 280 unq 0 iso 0 dist 9.0021 7.41099 5.41639 12.6862 6.53701 8.26589 10.0528 6.07005 4.45141 10.6192 14.0039 5.51836 7.96485 6.0664 7.38048 numMergedOcc 0
