0 mol 4 unq 0 iso 0 dist 8.67981 11.5212 6.12485 7.97369 6.66589 6.56189 14.676 6.21697 6.86951 9.80478 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 4.62913 4.60834 6.6051 5.85944 8.17618 6.67154 7.44542 10.1259 8.15864 12.5465 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 8.34804 10.7182 8.27009 16.4344 8.64208 13.0612 14.4837 10.6111 6.04303 14.601 numMergedOcc 0
3 mol 67 unq 1 iso 0 dist 8.34804 10.7182 8.27009 16.4344 8.64208 13.0612 9.59265 6.9953 6.12267 13.9132 numMergedOcc 0
4 mol 67 unq 2 iso 0 dist 8.34804 10.7182 8.27009 11.9474 7.9572 10.6864 14.4837 10.6111 6.04303 15.2666 numMergedOcc 0
5 mol 67 unq 3 iso 0 dist 8.34804 10.7182 8.27009 11.9474 7.9572 10.6864 9.59265 6.9953 6.12267 13.4813 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 6.97882 6.27329 5.62336 11.2491 9.1329 5.507 9.4868 5.38943 5.63748 5.26938 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 6.97882 6.27329 5.62336 5.00184 9.33217 5.76272 9.4868 5.38943 5.63748 11.099 numMergedOcc 0
8 mol 87 unq 2 iso 0 dist 6.97882 6.27329 5.62336 12.8734 9.03114 7.26523 9.4868 5.38943 5.63748 8.91602 numMergedOcc 0
9 mol 87 unq 3 iso 0 dist 9.4868 15.7737 9.90256 11.2491 5.26938 5.30415 15.7638 6.69898 7.57471 6.8014 numMergedOcc 0
10 mol 87 unq 4 iso 0 dist 9.4868 15.7737 9.90256 12.8734 8.91602 11.2095 15.7638 6.69898 7.57471 11.835 numMergedOcc 0
11 mol 87 unq 5 iso 0 dist 9.4868 6.27329 5.63748 11.2491 5.26938 5.507 6.97882 5.38943 5.62336 9.1329 numMergedOcc 0
12 mol 87 unq 6 iso 0 dist 9.4868 6.27329 5.63748 12.8734 8.91602 7.26523 6.97882 5.38943 5.62336 9.03114 numMergedOcc 0
13 mol 87 unq 7 iso 0 dist 7.7858 7.88443 5.62336 11.2195 9.1329 5.507 10.847 5.38943 5.63748 5.26938 numMergedOcc 0
14 mol 87 unq 8 iso 0 dist 7.7858 7.88443 5.62336 9.58456 9.33217 5.76272 10.847 5.38943 5.63748 11.099 numMergedOcc 0
15 mol 87 unq 9 iso 0 dist 7.7858 7.88443 5.62336 5.66355 9.03114 7.26523 10.847 5.38943 5.63748 8.91602 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 5.9962 5.9683 8.76088 4.58263 8.96061 8.99025 9.96416 9.34083 5.79195 13.8241 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 5.9962 5.9683 8.76088 4.58263 8.96061 8.99025 7.17051 11.2107 9.2759 10.2321 numMergedOcc 0
18 mol 133 unq 2 iso 0 dist 8.61448 13.8877 8.76088 10.1805 8.96061 8.99025 15.6986 9.34083 5.79195 13.8241 numMergedOcc 0
19 mol 133 unq 3 iso 0 dist 8.61448 13.8877 8.76088 10.1805 8.96061 8.99025 18.0226 11.2107 9.2759 10.2321 numMergedOcc 0
20 mol 168 unq 0 iso 0 dist 9.60268 9.78459 9.11481 6.51864 8.8573 5.06947 13.3612 6.11195 7.41092 9.35182 numMergedOcc 0
21 mol 168 unq 1 iso 0 dist 8.79954 9.70858 9.11481 5.14137 8.8573 5.06947 11.9617 6.11195 7.41092 9.35182 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 8.55805 4.74145 6.39087 15.5892 7.30244 12.2765 10.9802 6.99846 9.86144 9.58343 numMergedOcc 0
23 mol 220 unq 1 iso 0 dist 8.55805 4.74145 6.39087 15.0704 7.29796 13.2427 10.9802 6.99846 9.86144 12.0159 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 8.20542 4.60599 8.63249 11.2013 9.97357 13.6195 9.73914 15.386 7.74348 16.3801 numMergedOcc 0
25 mol 236 unq 1 iso 0 dist 8.20542 4.60599 8.63249 4.15973 6.36941 7.45579 9.73914 15.386 7.74348 12.2331 numMergedOcc 0
26 mol 236 unq 2 iso 0 dist 5.6568 4.24722 7.74348 9.22303 9.96011 13.0929 12.2537 15.386 8.63249 21.314 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 9.17911 13.8539 7.25618 9.07364 9.67877 15.0574 14.4126 7.64421 8.70193 17.1491 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 9.17911 13.8539 7.25618 17.1229 8.81059 4.51422 14.4126 7.64421 8.70193 7.9357 numMergedOcc 0
29 mol 258 unq 2 iso 0 dist 9.17911 13.8539 7.25618 15.539 9.12006 4.99997 14.4126 7.64421 8.70193 5.79537 numMergedOcc 0
30 mol 258 unq 3 iso 0 dist 9.52903 9.6053 7.25618 14.2753 9.67877 15.0574 12.3615 7.64421 8.70193 17.1491 numMergedOcc 0
31 mol 258 unq 4 iso 0 dist 9.52903 9.6053 7.25618 7.52881 8.81059 4.51422 12.3615 7.64421 8.70193 7.9357 numMergedOcc 0
32 mol 258 unq 5 iso 0 dist 9.52903 9.6053 7.25618 12.3042 9.12006 4.99997 12.3615 7.64421 8.70193 5.79537 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 6.70414 12.5633 8.15119 14.2115 9.84188 10.2486 16.5458 11.3688 6.66936 15.0284 numMergedOcc 0
34 mol 277 unq 1 iso 0 dist 6.70414 12.5633 8.15119 10.8075 8.35794 7.94155 16.5458 11.3688 6.66936 14.2462 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 7.47179 6.53276 6.45597 11.3154 7.13655 5.37435 10.6184 5.69849 9.18785 8.98486 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 7.47179 6.53276 6.45597 11.3154 7.13655 5.37435 10.6184 5.69849 9.18785 8.98486 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 7.47179 6.53276 6.45597 11.3154 7.13655 5.37435 10.6184 5.69849 9.18785 8.98486 numMergedOcc 0
