0 mol 25 unq 0 iso 0 dist 9.07927 6.44262 7.31767 8.50987 4.51512 6.03987 5.46378 8.43188 7.685 10.3635 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.50987 6.44262 6.03987 9.07927 4.51512 7.31767 5.46378 10.3635 7.685 8.43188 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.6112 9.99897 7.34143 13.5109 9.162 9.80098 12.5449 4.5482 7.18176 5.93337 numMergedOcc 0
3 mol 52 unq 1 iso 0 dist 6.08894 6.01116 7.34143 12.5042 9.162 9.80098 9.28632 4.5482 7.18176 5.93337 numMergedOcc 0
4 mol 52 unq 2 iso 0 dist 9.02308 4.98024 7.34143 14.4551 9.162 9.80098 10.5394 4.5482 7.18176 5.93337 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 7.89001 12.2366 9.5589 10.1199 5.08001 6.83299 12.7501 6.91765 5.02241 5.06052 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 7.89001 12.2366 9.5589 19.498 16.3192 8.10861 12.7501 6.91765 5.02241 10.1332 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 8.46313 9.46304 6.72123 10.2837 6.86346 6.65721 14.4753 7.39396 8.76003 5.83489 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 7.09258 10.0936 9.78528 13.592 8.24309 9.96708 10.2171 6.11922 7.321 9.0131 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 7.02792 11.4302 9.35224 10.3136 7.80879 9.60661 10.2102 5.69137 6.58204 10.9608 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 7.02792 11.4302 9.35224 14.4819 8.87654 7.17106 10.2102 5.69137 6.58204 5.01145 numMergedOcc 0
11 mol 100 unq 2 iso 0 dist 7.02792 6.20162 6.56369 9.16549 12.6515 7.47343 10.2102 5.69137 7.75343 15.209 numMergedOcc 0
12 mol 100 unq 3 iso 0 dist 7.02792 6.20162 6.56369 10.3136 7.80879 6.65086 10.2102 5.69137 7.75343 10.9608 numMergedOcc 0
13 mol 100 unq 4 iso 0 dist 7.02792 6.20162 6.56369 12.1758 6.39938 9.30209 10.2102 5.69137 7.75343 9.21622 numMergedOcc 0
14 mol 117 unq 0 iso 0 dist 8.98848 14.6144 7.90328 21.8083 13.1058 9.84395 12.7737 4.91401 6.62561 11.3679 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.85025 13.8058 8.00618 13.0581 8.18495 7.11802 17.4295 12.2037 7.92688 4.68409 numMergedOcc 0
16 mol 142 unq 0 iso 0 dist 6.91573 12.444 9.2313 12.0967 5.50998 7.73169 14.3906 9.49653 7.15475 7.53854 numMergedOcc 0
17 mol 142 unq 1 iso 0 dist 6.91573 12.444 9.2313 17.0821 11.1395 8.96657 14.3906 9.49653 7.15475 10.3477 numMergedOcc 0
18 mol 142 unq 2 iso 0 dist 6.91573 7.18287 5.31024 12.0967 5.50998 7.26382 14.3906 9.49653 9.07935 7.53854 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 9.56095 6.64179 6.23493 10.1181 5.71071 7.46303 13.8981 4.9093 9.17284 6.3437 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 9.5181 9.15708 9.36357 16.7157 12.1694 8.34494 12.3333 11.4315 6.25105 10.3337 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 9.5181 9.15708 9.36357 12.0771 7.82322 6.56247 12.3333 11.4315 6.25105 11.216 numMergedOcc 0
22 mol 234 unq 2 iso 0 dist 9.5181 4.94699 6.7625 12.0771 7.82322 9.45496 13.0958 14.4106 9.5707 15.9563 numMergedOcc 0
23 mol 234 unq 3 iso 0 dist 9.5181 4.94699 6.7625 12.0771 7.82322 9.45496 12.3333 11.4315 7.85175 11.216 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.70852 5.07898 7.84554 11.1914 4.86771 7.88519 9.19369 11.8736 7.48005 11.6195 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 8.70852 5.07898 7.84554 9.89728 7.64658 7.46176 9.19369 11.8736 7.48005 5.79468 numMergedOcc 0
26 mol 259 unq 2 iso 0 dist 8.70852 5.07898 7.84554 6.42437 5.87173 9.18903 9.19369 11.8736 7.48005 12.6649 numMergedOcc 0
27 mol 259 unq 3 iso 0 dist 9.89728 5.07898 7.46176 11.1914 6.96053 7.88519 9.19369 5.79468 7.48005 11.6195 numMergedOcc 0
28 mol 259 unq 4 iso 0 dist 9.89728 5.07898 7.46176 8.70852 7.64658 7.84554 9.19369 5.79468 7.48005 11.8736 numMergedOcc 0
29 mol 259 unq 5 iso 0 dist 9.89728 5.07898 7.46176 6.42437 10.5239 9.18903 9.19369 5.79468 7.48005 12.6649 numMergedOcc 0
30 mol 259 unq 6 iso 0 dist 6.42437 5.07898 9.18903 11.1914 10.4881 7.88519 9.19369 12.6649 7.48005 11.6195 numMergedOcc 0
31 mol 259 unq 7 iso 0 dist 6.42437 5.07898 9.18903 8.70852 5.87173 7.84554 9.19369 12.6649 7.48005 11.8736 numMergedOcc 0
32 mol 259 unq 8 iso 0 dist 6.42437 5.07898 9.18903 9.89728 10.5239 7.46176 9.19369 12.6649 7.48005 5.79468 numMergedOcc 0
