0 mol 7 unq 0 iso 0 dist 9.68596 9.87885 10.1841 9.0379 6.7985 10.25 13.2247 12.9581 6.1206 15.4949 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.72114 9.67164 5.5683 11.8172 6.02702 10.2465 12.2041 10.3148 5.99459 15.8875 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.99972 5.99459 6.12483 5.13353 9.68006 10.1349 12.2041 11.2662 9.67164 17.3085 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 7.03958 6.56356 4.1204 12.4076 8.53529 12.536 10.9495 7.18019 9.01112 8.4069 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 7.03958 6.56356 4.1204 12.4076 8.53529 12.536 8.09332 8.44009 7.62333 12.9016 numMergedOcc 0
5 mol 8 unq 2 iso 0 dist 7.03958 6.56356 4.1204 10.9495 7.18019 9.01112 8.09332 8.44009 7.62333 6.23795 numMergedOcc 0
6 mol 8 unq 3 iso 0 dist 7.03958 6.56356 4.1204 8.09332 8.44009 7.62333 10.9495 7.18019 9.01112 6.23795 numMergedOcc 0
7 mol 8 unq 4 iso 0 dist 7.18019 9.01112 4.1204 10.9495 7.03958 6.56356 6.23795 8.44009 7.62333 8.09332 numMergedOcc 0
8 mol 8 unq 5 iso 0 dist 7.18019 9.01112 4.1204 8.4069 8.53529 12.536 10.9495 7.03958 6.56356 12.4076 numMergedOcc 0
9 mol 8 unq 6 iso 0 dist 7.18019 9.01112 4.1204 8.4069 8.53529 12.536 6.23795 8.44009 7.62333 12.9016 numMergedOcc 0
10 mol 8 unq 7 iso 0 dist 7.18019 9.01112 4.1204 6.23795 8.44009 7.62333 10.9495 7.03958 6.56356 8.09332 numMergedOcc 0
11 mol 8 unq 8 iso 0 dist 8.44009 7.62333 4.1204 8.09332 7.03958 6.56356 6.23795 7.18019 9.01112 10.9495 numMergedOcc 0
12 mol 8 unq 9 iso 0 dist 8.44009 7.62333 4.1204 12.9016 8.53529 12.536 8.09332 7.03958 6.56356 12.4076 numMergedOcc 0
13 mol 8 unq 10 iso 0 dist 8.44009 7.62333 4.1204 12.9016 8.53529 12.536 6.23795 7.18019 9.01112 8.4069 numMergedOcc 0
14 mol 8 unq 11 iso 0 dist 8.44009 7.62333 4.1204 6.23795 7.18019 9.01112 8.09332 7.03958 6.56356 10.9495 numMergedOcc 0
15 mol 25 unq 0 iso 0 dist 7.92503 9.48085 10.2758 10.6808 8.6653 17.8732 10.9391 16.8925 9.49421 21.6105 numMergedOcc 0
16 mol 58 unq 0 iso 0 dist 5.93884 9.22598 5.66912 5.30792 9.92355 13.3281 4.81926 7.68678 8.96727 5.35073 numMergedOcc 0
17 mol 58 unq 1 iso 0 dist 7.68678 8.96727 5.66912 5.35073 9.92355 13.3281 4.81926 5.93884 9.22598 5.30792 numMergedOcc 0
18 mol 98 unq 0 iso 0 dist 6.7117 5.10496 3.94967 8.40073 4.47349 5.2571 9.51923 9.42961 5.92242 9.42358 numMergedOcc 0
19 mol 98 unq 1 iso 0 dist 6.7117 5.10496 3.94967 8.40073 4.47349 5.2571 10.2427 5.65185 8.7497 5.02887 numMergedOcc 0
20 mol 98 unq 2 iso 0 dist 6.7117 5.10496 3.94967 10.2427 5.65185 8.7497 9.51923 9.42961 5.92242 13.9786 numMergedOcc 0
21 mol 98 unq 3 iso 0 dist 6.7117 5.10496 3.94967 10.2427 5.65185 8.7497 8.40073 4.47349 5.2571 5.02887 numMergedOcc 0
22 mol 98 unq 4 iso 0 dist 7.23884 9.64383 12.82 7.51619 5.78706 11.2061 13.659 18.2503 7.54889 17.9581 numMergedOcc 0
23 mol 98 unq 5 iso 0 dist 7.23884 9.64383 12.82 7.51619 5.78706 11.2061 14.591 17.2188 7.78931 17.7405 numMergedOcc 0
24 mol 98 unq 6 iso 0 dist 7.23884 9.64383 12.82 11.4338 5.59328 14.7009 13.659 18.2503 7.54889 19.2253 numMergedOcc 0
25 mol 98 unq 7 iso 0 dist 7.23884 9.64383 12.82 11.4338 5.59328 14.7009 14.591 17.2188 7.78931 16.8302 numMergedOcc 0
26 mol 98 unq 8 iso 0 dist 7.23884 9.64383 12.82 9.30161 7.5242 16.3626 13.659 18.2503 7.54889 19.0362 numMergedOcc 0
27 mol 98 unq 9 iso 0 dist 7.23884 9.64383 12.82 9.30161 7.5242 16.3626 14.591 17.2188 7.78931 18.1756 numMergedOcc 0
28 mol 98 unq 10 iso 0 dist 4.47349 7.54889 3.92737 8.40073 6.7117 9.81956 13.659 12.5931 9.64383 18.6405 numMergedOcc 0
29 mol 98 unq 11 iso 0 dist 4.47349 7.54889 3.92737 8.40073 6.7117 9.81956 5.02887 5.65185 7.78931 10.2427 numMergedOcc 0
30 mol 98 unq 12 iso 0 dist 4.47349 7.54889 3.92737 5.02887 5.65185 7.78931 13.659 12.5931 9.64383 14.591 numMergedOcc 0
31 mol 98 unq 13 iso 0 dist 4.47349 5.2571 3.94967 8.40073 6.7117 5.10496 9.42358 9.42961 5.92242 9.51923 numMergedOcc 0
32 mol 98 unq 14 iso 0 dist 4.47349 5.2571 3.94967 8.40073 6.7117 5.10496 5.02887 5.65185 8.7497 10.2427 numMergedOcc 0
33 mol 98 unq 15 iso 0 dist 4.47349 5.2571 3.94967 5.02887 5.65185 8.7497 8.40073 6.7117 5.10496 10.2427 numMergedOcc 0
34 mol 98 unq 16 iso 0 dist 4.47349 5.2571 3.94967 5.02887 5.65185 8.7497 9.42358 9.42961 5.92242 13.9786 numMergedOcc 0
35 mol 98 unq 17 iso 0 dist 5.65185 7.78931 3.92737 10.2427 6.7117 9.81956 14.591 12.5931 9.64383 18.6405 numMergedOcc 0
36 mol 98 unq 18 iso 0 dist 5.65185 7.78931 3.92737 10.2427 6.7117 9.81956 5.02887 4.47349 7.54889 8.40073 numMergedOcc 0
37 mol 98 unq 19 iso 0 dist 5.65185 7.78931 3.92737 5.02887 4.47349 7.54889 14.591 12.5931 9.64383 13.659 numMergedOcc 0
38 mol 98 unq 20 iso 0 dist 5.65185 8.7497 3.94967 10.2427 6.7117 5.10496 13.9786 9.42961 5.92242 9.51923 numMergedOcc 0
39 mol 98 unq 21 iso 0 dist 5.65185 8.7497 3.94967 10.2427 6.7117 5.10496 5.02887 4.47349 5.2571 8.40073 numMergedOcc 0
40 mol 98 unq 22 iso 0 dist 5.65185 8.7497 3.94967 5.02887 4.47349 5.2571 10.2427 6.7117 5.10496 8.40073 numMergedOcc 0
41 mol 98 unq 23 iso 0 dist 5.65185 8.7497 3.94967 5.02887 4.47349 5.2571 13.9786 9.42961 5.92242 9.42358 numMergedOcc 0
42 mol 100 unq 0 iso 0 dist 7.80975 9.21662 12.48 10.8586 7.10378 10.5432 10.8375 14.8081 8.91882 11.5403 numMergedOcc 0
43 mol 119 unq 0 iso 0 dist 9.11344 6.99446 5.37917 4.85907 6.52773 7.64052 10.9871 9.87889 8.95212 9.93257 numMergedOcc 0
44 mol 119 unq 1 iso 0 dist 6.52773 7.64052 5.37917 4.85907 9.11344 6.99446 9.93257 9.87889 8.95212 10.9871 numMergedOcc 0
45 mol 133 unq 0 iso 0 dist 7.71248 8.26547 8.88402 6.761 9.97654 12.4934 5.61668 12.4749 9.05342 8.28069 numMergedOcc 0
46 mol 133 unq 1 iso 0 dist 7.71248 8.26547 8.88402 7.6656 6.66772 13.5471 5.61668 12.4749 9.05342 12.4308 numMergedOcc 0
47 mol 134 unq 0 iso 0 dist 6.23142 9.33094 6.93712 5.00526 7.69991 11.2896 6.81259 9.94764 8.69531 11.3271 numMergedOcc 0
48 mol 134 unq 1 iso 0 dist 9.94764 9.1998 11.5269 11.3271 7.69991 12.4385 11.6064 12.1214 6.42772 9.04023 numMergedOcc 0
49 mol 134 unq 2 iso 0 dist 9.94764 9.1998 11.5269 11.3271 7.69991 12.4385 7.09823 15.049 8.70621 17.1857 numMergedOcc 0
50 mol 134 unq 3 iso 0 dist 9.94764 9.1998 11.5269 6.81259 6.23142 11.0808 11.6064 12.1214 6.42772 10.1584 numMergedOcc 0
51 mol 134 unq 4 iso 0 dist 9.94764 9.1998 11.5269 6.81259 6.23142 11.0808 7.09823 15.049 8.70621 13.4122 numMergedOcc 0
52 mol 134 unq 5 iso 0 dist 9.94764 8.69531 6.93712 11.3271 7.69991 11.2896 6.81259 6.23142 9.33094 5.00526 numMergedOcc 0
53 mol 181 unq 0 iso 0 dist 6.2479 9.76212 6.39406 8.88798 7.99195 13.2783 6.01247 6.22122 8.59874 12.6324 numMergedOcc 0
54 mol 181 unq 1 iso 0 dist 6.22122 8.59874 6.39406 12.6324 7.99195 13.2783 6.01247 6.2479 9.76212 8.88798 numMergedOcc 0
55 mol 186 unq 0 iso 0 dist 7.76163 7.05695 3.78314 14.5862 8.73217 10.8806 6.83796 10.5615 9.3498 13.4725 numMergedOcc 0
56 mol 186 unq 1 iso 0 dist 8.73217 6.61112 4.03697 14.5862 7.76163 11.651 7.09479 10.6519 8.90571 14.9196 numMergedOcc 0
57 mol 238 unq 0 iso 0 dist 9.24557 9.72188 17.1065 10.0191 7.57812 14.4013 15.7907 21.6822 9.12776 20.8128 numMergedOcc 0
58 mol 259 unq 0 iso 0 dist 7.08526 5.85442 4.47425 6.96053 7.98231 10.3406 9.98105 10.4552 6.9899 15.8535 numMergedOcc 0
