0 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 5.69214 7.95042 11.8884 7.29868 8.52463 13.719 5.80953 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 6.81627 8.26899 5.98837 5.61579 5.38524 7.03126 14.2075 9.37804 11.6859 9.02642 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 7.32874 8.26899 4.55117 5.61579 8.69057 7.03126 14.2075 14.0374 11.6859 9.02642 numMergedOcc 0
3 mol 58 unq 2 iso 0 dist 6.62496 9.58673 10.2241 9.87158 9.22598 15.7229 8.80614 9.95364 8.88332 9.01564 numMergedOcc 0
4 mol 58 unq 3 iso 0 dist 6.35756 9.58673 7.05413 9.87158 8.96727 15.7229 8.80614 5.49591 8.88332 9.01564 numMergedOcc 0
5 mol 58 unq 4 iso 0 dist 6.35756 9.58673 7.05413 5.86526 8.01308 12.8612 8.80614 5.49591 8.88332 7.11065 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 9.96708 6.77912 7.11552 5.69391 9.55118 5.4605 9.27838 11.6378 4.67641 7.58875 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 9.78528 9.02278 11.6894 9.78221 9.55118 16.0371 16.0048 11.6378 19.3148 7.58875 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.33898 8.36431 10.9701 4.3481 7.06939 10.5758 9.75237 9.44576 16.7823 6.87506 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 9.64443 8.36431 12.4284 5.31547 9.36001 13.3865 9.75237 13.9524 16.7823 6.59716 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 9.60661 6.58204 10.9608 4.03277 8.91882 10.259 9.1361 6.71012 13.6642 6.55173 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 9.60661 6.58204 10.9608 4.03277 8.91882 10.259 7.01812 5.80144 10.0891 6.59691 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 6.65086 7.75343 10.9608 6.23008 8.91882 10.259 9.5074 6.71012 13.6642 6.55173 numMergedOcc 0
13 mol 100 unq 3 iso 0 dist 6.65086 7.75343 10.9608 6.23008 8.91882 10.259 8.30845 5.80144 10.0891 6.59691 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 8.69985 5.87358 9.46098 5.00433 8.52024 9.74008 7.80523 7.74599 6.89298 7.56755 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 9.68677 7.64052 9.08536 17.8739 12.0175 15.4934 8.67537 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 9.87172 9.38288 11.7228 6.20019 6.99446 12.4009 11.5311 10.8661 11.4228 8.67537 numMergedOcc 0
17 mol 119 unq 2 iso 0 dist 9.87172 6.19042 6.35763 6.20019 6.99446 6.13374 11.5311 10.8661 7.39626 8.67537 numMergedOcc 0
18 mol 119 unq 3 iso 0 dist 9.87172 7.44174 7.36192 6.20019 6.99446 9.08536 11.5311 10.8661 15.4934 8.67537 numMergedOcc 0
19 mol 119 unq 4 iso 0 dist 6.18601 9.80862 9.35964 4.39676 8.95212 9.56225 6.73586 5.13589 4.95807 8.67537 numMergedOcc 0
20 mol 119 unq 5 iso 0 dist 6.18601 8.43904 10.3457 4.39676 8.95212 6.13374 6.73586 5.13589 7.39626 8.67537 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 8.00618 7.92688 12.2037 15.0115 8.77023 16.243 10.9061 4.54648 16.2339 8.83732 numMergedOcc 0
22 mol 155 unq 0 iso 0 dist 7.46303 9.17284 6.3437 9.16779 8.97626 13.5963 12.2416 5.50031 10.1521 9.16358 numMergedOcc 0
23 mol 155 unq 1 iso 0 dist 7.46303 9.17284 6.3437 9.16779 8.97626 13.5963 10.9606 6.89781 7.6506 9.24038 numMergedOcc 0
24 mol 155 unq 2 iso 0 dist 6.43582 9.38946 12.8482 4.91785 8.97626 7.29911 7.92304 5.50031 9.50478 9.16358 numMergedOcc 0
25 mol 155 unq 3 iso 0 dist 6.43582 9.38946 12.8482 4.91785 8.97626 7.29911 10.3161 6.89781 12.0574 9.24038 numMergedOcc 0
26 mol 155 unq 4 iso 0 dist 6.43582 7.36102 8.27726 4.91785 8.97626 5.36254 7.92304 5.50031 5.50045 9.16358 numMergedOcc 0
27 mol 155 unq 5 iso 0 dist 6.43582 7.36102 8.27726 4.91785 8.97626 5.36254 10.3161 6.89781 6.40403 9.24038 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 9.1374 6.94688 6.25083 12.9532 9.76212 14.5897 12.4878 4.43096 10.6325 7.35884 numMergedOcc 0
29 mol 181 unq 1 iso 0 dist 9.1374 6.71012 4.77278 12.9532 9.76212 12.3788 12.4878 4.43096 8.45963 7.35884 numMergedOcc 0
30 mol 181 unq 2 iso 0 dist 7.81386 4.93785 6.7991 6.8757 6.64173 9.09234 10.4943 5.63555 11.5017 8.12266 numMergedOcc 0
31 mol 181 unq 3 iso 0 dist 7.81386 4.93785 6.7991 5.71898 9.01624 6.76746 9.39829 7.20191 7.30555 5.99437 numMergedOcc 0
32 mol 181 unq 4 iso 0 dist 7.81386 4.93785 6.7991 5.83796 9.55105 8.92098 10.4943 5.63555 11.5017 9.43306 numMergedOcc 0
33 mol 181 unq 5 iso 0 dist 7.81386 4.93785 6.7991 5.83796 9.55105 8.92098 9.39829 7.20191 7.30555 8.4848 numMergedOcc 0
34 mol 181 unq 6 iso 0 dist 7.63312 6.93764 4.80231 10.6474 6.64173 10.9785 5.9176 5.63555 5.60306 8.12266 numMergedOcc 0
35 mol 181 unq 7 iso 0 dist 7.63312 6.93764 4.80231 5.93724 9.01624 10.1634 6.41453 7.20191 6.05477 5.99437 numMergedOcc 0
36 mol 181 unq 8 iso 0 dist 7.63312 6.93764 4.80231 5.12833 9.55105 10.9567 5.9176 5.63555 5.60306 9.43306 numMergedOcc 0
37 mol 181 unq 9 iso 0 dist 7.63312 6.93764 4.80231 5.12833 9.55105 10.9567 6.41453 7.20191 6.05477 8.4848 numMergedOcc 0
38 mol 222 unq 0 iso 0 dist 7.21333 6.82208 12.2813 6.84862 5.56538 11.8745 7.67576 7.75656 7.39748 8.43195 numMergedOcc 0
39 mol 222 unq 1 iso 0 dist 7.21333 6.82208 12.2813 9.53117 7.48954 12.9858 7.67576 7.75656 7.39748 8.23406 numMergedOcc 0
40 mol 224 unq 0 iso 0 dist 6.61986 8.19953 10.7113 5.13732 8.08349 5.73591 10.0553 10.7174 6.957 5.05368 numMergedOcc 0
41 mol 224 unq 1 iso 0 dist 6.57273 6.87664 7.12232 7.05804 8.79428 10.8888 11.9653 7.38836 11.1486 9.25617 numMergedOcc 0
42 mol 224 unq 2 iso 0 dist 6.57273 6.87664 7.12232 7.05804 8.79428 10.8888 14.5387 12.4832 14.4324 9.05276 numMergedOcc 0
43 mol 224 unq 3 iso 0 dist 5.78342 6.87664 5.3621 7.05804 6.8692 10.8888 11.9653 10.6079 11.1486 9.25617 numMergedOcc 0
44 mol 224 unq 4 iso 0 dist 5.78342 6.87664 5.3621 7.05804 6.8692 10.8888 14.5387 11.5752 14.4324 9.05276 numMergedOcc 0
