0 mol 19 unq 0 iso 0 dist 8.23643 7.75618 14.4867 5.03957 8.73972 12.3215 5.5841 13.6944 7.02548 7.42082 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.20943 8.40416 11.4087 7.83352 6.00439 15.4288 6.74265 10.7418 7.02548 12.0759 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 6.20943 8.40416 11.4087 7.67038 7.82528 7.75618 6.74265 10.7418 7.02548 5.5841 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 7.82528 7.75618 11.4087 10.8007 6.00439 15.4288 5.5841 10.7418 7.02548 12.0759 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 7.82528 7.75618 11.4087 7.67038 6.20943 8.40416 5.5841 10.7418 7.02548 6.74265 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 8.58657 6.41423 5.90856 7.07775 9.80108 10.741 4.69858 10.7418 5.82366 10.4988 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 8.82012 6.46104 4.98603 13.2136 9.16962 10.177 11.0099 11.0822 7.3022 9.87119 numMergedOcc 0
7 mol 45 unq 0 iso 0 dist 9.43442 9.53378 8.70414 5.48601 7.06308 10.862 5.54436 8.59109 5.55096 9.01651 numMergedOcc 0
8 mol 45 unq 1 iso 0 dist 9.43442 9.53378 8.70414 5.101 6.34173 10.6216 5.54436 8.59109 5.55096 6.89191 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 7.08557 9.33535 13.2397 6.75888 8.80108 8.71468 6.78077 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.71128 6.84011 9.23527 5.59517 7.52743 10.0237 5.31367 11.976 8.809 6.13783 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 8.71128 6.84011 9.23527 5.59517 7.52743 10.0237 8.88748 10.1737 5.79343 8.98061 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 6.91348 8.70296 9.93183 6.63273 8.6243 12.6227 7.90484 13.8783 9.2235 10.5216 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 9.87281 8.69157 7.6506 10.6882 9.17284 10.9606 5.48883 6.51096 9.0529 6.3845 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 9.87281 8.69157 7.6506 10.6882 9.17284 10.9606 8.78665 10.3514 7.55196 5.86939 numMergedOcc 0
15 mol 155 unq 2 iso 0 dist 9.87281 8.69157 7.6506 4.66274 8.87452 10.8572 5.48883 6.51096 9.0529 5.77564 numMergedOcc 0
16 mol 155 unq 3 iso 0 dist 9.87281 8.69157 7.6506 4.66274 8.87452 10.8572 8.78665 10.3514 7.55196 12.1476 numMergedOcc 0
17 mol 155 unq 4 iso 0 dist 7.39644 6.53347 6.40403 10.7616 7.36102 10.3161 9.36596 13.2154 9.0529 12.1814 numMergedOcc 0
18 mol 155 unq 5 iso 0 dist 7.39644 6.53347 6.40403 10.7616 7.36102 10.3161 5.40375 7.37901 7.55196 6.34186 numMergedOcc 0
19 mol 155 unq 6 iso 0 dist 7.36102 7.92304 5.50045 10.7616 7.39644 11.1616 6.34186 7.37901 9.80845 5.40375 numMergedOcc 0
20 mol 155 unq 7 iso 0 dist 8.65888 8.69157 4.40321 7.01918 7.70572 6.53347 5.48883 11.1032 9.0529 9.36596 numMergedOcc 0
21 mol 155 unq 8 iso 0 dist 8.65888 8.69157 4.40321 7.01918 7.70572 6.53347 8.78665 10.9049 7.55196 5.40375 numMergedOcc 0
22 mol 155 unq 9 iso 0 dist 7.70572 6.53347 4.40321 7.01918 8.65888 8.69157 9.36596 11.1032 9.0529 5.48883 numMergedOcc 0
23 mol 155 unq 10 iso 0 dist 7.70572 6.53347 4.40321 7.01918 8.65888 8.69157 5.40375 10.9049 7.55196 8.78665 numMergedOcc 0
24 mol 155 unq 11 iso 0 dist 8.27111 8.69157 6.00473 4.66274 7.68368 10.8572 5.48883 8.73171 9.0529 5.77564 numMergedOcc 0
25 mol 155 unq 12 iso 0 dist 8.27111 8.69157 6.00473 4.66274 7.68368 10.8572 8.78665 11.8293 7.55196 12.1476 numMergedOcc 0
26 mol 156 unq 0 iso 0 dist 9.36805 9.44367 10.143 5.76755 8.47155 13.5699 7.29758 6.90155 5.81122 9.30783 numMergedOcc 0
27 mol 156 unq 1 iso 0 dist 9.36805 9.44367 10.143 8.38403 7.55203 10.3379 7.29758 6.90155 5.81122 4.53931 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 4.96364 9.62952 12.3651 8.78722 10.3168 7.17337 9.89211 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 9.58736 9.55668 13.128 9.85037 9.43058 10.076 4.65302 11.9287 7.95766 7.82697 numMergedOcc 0
30 mol 235 unq 1 iso 0 dist 9.58736 9.55668 13.128 13.6669 8.75735 14.3922 4.65302 11.9287 7.95766 12.9071 numMergedOcc 0
31 mol 235 unq 2 iso 0 dist 9.58736 9.55668 13.128 16.4493 6.98084 18.022 4.65302 11.9287 7.95766 18.5899 numMergedOcc 0
32 mol 235 unq 3 iso 0 dist 9.58736 9.55668 13.128 15.4 7.32211 20.3456 4.65302 11.9287 7.95766 17.8876 numMergedOcc 0
33 mol 238 unq 0 iso 0 dist 9.29858 9.24557 10.3809 10.1648 9.68513 10.1217 11.0401 16.2894 8.90076 10.2681 numMergedOcc 0
34 mol 238 unq 1 iso 0 dist 9.29858 9.24557 10.3809 10.1648 9.68513 10.1217 8.85181 12.4232 6.87131 15.3074 numMergedOcc 0
35 mol 238 unq 2 iso 0 dist 9.29858 9.24557 10.3809 10.1648 9.68513 10.1217 11.9142 16.7658 8.09718 17.0128 numMergedOcc 0
36 mol 238 unq 3 iso 0 dist 9.90142 7.57812 10.3147 5.40359 5.9216 10.1217 5.11565 14.5719 8.90076 10.2681 numMergedOcc 0
37 mol 238 unq 4 iso 0 dist 9.90142 7.57812 10.3147 5.40359 5.9216 10.1217 13.0842 14.6581 6.87131 15.3074 numMergedOcc 0
38 mol 238 unq 5 iso 0 dist 9.90142 7.57812 10.3147 5.40359 5.9216 10.1217 13.171 17.8749 8.09718 17.0128 numMergedOcc 0
39 mol 238 unq 6 iso 0 dist 9.90142 8.69104 15.6823 5.40359 5.9216 13.492 5.11565 14.5719 6.62002 10.2681 numMergedOcc 0
40 mol 238 unq 7 iso 0 dist 9.90142 8.69104 15.6823 5.40359 5.9216 13.492 13.0842 14.6581 9.69818 15.3074 numMergedOcc 0
41 mol 238 unq 8 iso 0 dist 9.90142 8.69104 15.6823 5.40359 5.9216 13.492 13.171 17.8749 6.73446 17.0128 numMergedOcc 0
42 mol 238 unq 9 iso 0 dist 6.05141 8.94014 11.5793 5.6348 8.09066 7.02333 10.8635 11.5207 7.04753 5.68826 numMergedOcc 0
43 mol 238 unq 10 iso 0 dist 6.05141 8.94014 11.5793 8.87326 7.2766 8.67864 10.8635 11.5207 7.04753 4.87097 numMergedOcc 0
44 mol 238 unq 11 iso 0 dist 8.14172 7.02333 4.38002 5.31152 6.77463 8.67864 5.68826 6.00721 7.04753 4.87097 numMergedOcc 0
45 mol 238 unq 12 iso 0 dist 8.09066 7.02333 11.5793 5.6348 6.05141 8.94014 5.68826 11.5207 7.04753 10.8635 numMergedOcc 0
46 mol 238 unq 13 iso 0 dist 8.09066 7.02333 11.5793 5.31152 7.2766 8.67864 5.68826 11.5207 7.04753 4.87097 numMergedOcc 0
47 mol 238 unq 14 iso 0 dist 6.77463 8.67864 4.38002 5.31152 8.14172 7.02333 4.87097 6.00721 7.04753 5.68826 numMergedOcc 0
48 mol 238 unq 15 iso 0 dist 7.2766 8.67864 11.5793 8.87326 6.05141 8.94014 4.87097 11.5207 7.04753 10.8635 numMergedOcc 0
49 mol 238 unq 16 iso 0 dist 7.2766 8.67864 11.5793 5.31152 8.09066 7.02333 4.87097 11.5207 7.04753 5.68826 numMergedOcc 0
