0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 15.8072 8.72114 13.8829 16.6461 9.67164 13.156 5.5683 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.51421 10.6104 8.41585 4.60206 5.99972 12.0193 4.7739 5.99459 6.88805 6.12483 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.91301 8.25051 9.62879 10.4489 7.18019 4.36226 13.8883 9.01112 7.12261 4.1204 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 6.40447 8.09311 11.6226 15.4445 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 3.96014 9.05357 13.1949 11.8971 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 6.11056 10.4744 8.86116 4.04757 8.44664 10.971 6.40447 8.09311 11.6226 3.84336 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.11056 10.4744 8.86116 4.04757 8.44664 10.971 3.96014 9.05357 13.1949 7.01276 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 6.11056 10.4744 8.86116 6.66757 9.44691 13.4893 6.40447 8.09311 11.6226 13.0295 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 6.11056 10.4744 8.86116 6.66757 9.44691 13.4893 3.96014 9.05357 13.1949 4.02219 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 6.40447 8.09311 6.17155 15.4445 numMergedOcc 0
10 mol 24 unq 7 iso 0 dist 6.11056 6.9756 8.38394 11.095 8.60554 12.3994 3.96014 9.05357 10.3122 11.8971 numMergedOcc 0
11 mol 24 unq 8 iso 0 dist 6.11056 6.9756 8.38394 4.04757 8.44664 5.30734 6.40447 8.09311 6.17155 3.84336 numMergedOcc 0
12 mol 24 unq 9 iso 0 dist 6.11056 6.9756 8.38394 4.04757 8.44664 5.30734 3.96014 9.05357 10.3122 7.01276 numMergedOcc 0
13 mol 24 unq 10 iso 0 dist 6.11056 6.9756 8.38394 6.66757 9.44691 12.505 6.40447 8.09311 6.17155 13.0295 numMergedOcc 0
14 mol 24 unq 11 iso 0 dist 6.11056 6.9756 8.38394 6.66757 9.44691 12.505 3.96014 9.05357 10.3122 4.02219 numMergedOcc 0
15 mol 25 unq 0 iso 0 dist 8.40051 13.466 7.57578 4.32173 6.16347 9.34396 6.29702 4.79873 10.2864 5.46578 numMergedOcc 0
16 mol 25 unq 1 iso 0 dist 8.40051 13.466 7.57578 4.32173 6.16347 9.34396 13.591 9.48085 5.18617 9.62058 numMergedOcc 0
17 mol 25 unq 2 iso 0 dist 8.40051 13.466 7.57578 15.9662 7.92503 6.11127 6.29702 4.79873 10.2864 11.0175 numMergedOcc 0
18 mol 25 unq 3 iso 0 dist 8.40051 13.466 7.57578 15.9662 7.92503 6.11127 13.591 9.48085 5.18617 10.2758 numMergedOcc 0
19 mol 25 unq 4 iso 0 dist 8.40051 14.4191 7.17969 4.32173 6.16347 10.8498 6.29702 4.79873 11.4148 5.46578 numMergedOcc 0
20 mol 25 unq 5 iso 0 dist 8.40051 14.4191 7.17969 4.32173 6.16347 10.8498 13.591 9.48085 5.68041 9.62058 numMergedOcc 0
21 mol 25 unq 6 iso 0 dist 8.40051 14.4191 7.17969 15.9662 7.92503 5.30154 6.29702 4.79873 11.4148 11.0175 numMergedOcc 0
22 mol 25 unq 7 iso 0 dist 8.40051 14.4191 7.17969 15.9662 7.92503 5.30154 13.591 9.48085 5.68041 10.2758 numMergedOcc 0
23 mol 25 unq 8 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 5.23233 6.55597 4.69295 4.98822 numMergedOcc 0
24 mol 25 unq 9 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 10.0172 7.52933 5.03027 11.0227 numMergedOcc 0
25 mol 25 unq 10 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 13.5673 9.71956 12.2542 10.3547 numMergedOcc 0
26 mol 25 unq 11 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 10.4709 7.07751 8.79309 7.91914 numMergedOcc 0
27 mol 25 unq 12 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 12.2787 8.23761 8.17061 11.7069 numMergedOcc 0
28 mol 25 unq 13 iso 0 dist 8.6396 5.8503 5.04899 4.32173 7.45383 7.33728 13.591 9.49421 13.6145 9.62058 numMergedOcc 0
29 mol 25 unq 14 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 5.23233 6.55597 4.69295 13.4321 numMergedOcc 0
30 mol 25 unq 15 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 13.5673 9.71956 12.2542 8.84447 numMergedOcc 0
31 mol 25 unq 16 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 10.4709 7.07751 8.79309 9.66912 numMergedOcc 0
32 mol 25 unq 17 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 12.2787 8.23761 8.17061 13.1117 numMergedOcc 0
33 mol 25 unq 18 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 10.0172 7.52933 5.03027 15.1255 numMergedOcc 0
34 mol 25 unq 19 iso 0 dist 8.6396 5.8503 5.04899 16.0077 9.01548 13.9331 13.591 9.49421 13.6145 5.38592 numMergedOcc 0
35 mol 25 unq 20 iso 0 dist 7.63928 6.17631 6.03987 9.78075 6.85556 5.68392 4.88495 7.99919 4.77954 6.19011 numMergedOcc 0
36 mol 56 unq 0 iso 0 dist 7.20538 6.93876 8.66265 3.63144 7.16773 6.63327 7.2452 9.03564 6.75591 9.76482 numMergedOcc 0
37 mol 58 unq 0 iso 0 dist 6.36193 5.40367 6.62496 4.37642 5.93884 5.78774 4.99692 9.22598 9.87158 5.66912 numMergedOcc 0
38 mol 58 unq 1 iso 0 dist 4.88613 5.40367 6.35756 4.37642 7.68678 5.78774 4.99692 8.96727 9.87158 5.66912 numMergedOcc 0
39 mol 58 unq 2 iso 0 dist 4.88613 5.40367 6.35756 4.37642 7.68678 5.78774 3.70586 8.01308 5.86526 5.76523 numMergedOcc 0
40 mol 85 unq 0 iso 0 dist 6.58793 10.1919 7.95579 3.88757 7.54568 10.2865 6.97936 7.7068 6.36397 4.93735 numMergedOcc 0
41 mol 85 unq 1 iso 0 dist 6.58793 9.21014 6.19965 3.88757 7.54568 8.09967 6.97936 7.7068 4.41789 4.93735 numMergedOcc 0
42 mol 85 unq 2 iso 0 dist 6.58793 7.83419 7.66905 3.88757 7.54568 4.65335 6.97936 7.7068 5.59906 4.93735 numMergedOcc 0
43 mol 109 unq 0 iso 0 dist 8.3164 11.5656 8.69985 4.81814 7.80523 7.74599 8.08642 7.07971 4.69373 5.92927 numMergedOcc 0
44 mol 113 unq 0 iso 0 dist 8.89481 4.36935 5.86073 11.2266 8.8822 10.1816 7.09333 8.80934 5.70579 7.1951 numMergedOcc 0
45 mol 113 unq 1 iso 0 dist 8.89481 4.36935 5.86073 9.01097 9.66219 8.42718 7.09333 8.80934 5.70579 3.84573 numMergedOcc 0
46 mol 119 unq 0 iso 0 dist 6.18763 5.3154 6.18601 6.49348 8.00003 10.4376 5.92411 8.95212 4.39676 12.3661 numMergedOcc 0
47 mol 119 unq 1 iso 0 dist 8.44385 12.1192 9.87172 4.01593 9.11344 10.9441 5.92411 6.99446 6.20019 5.37917 numMergedOcc 0
48 mol 119 unq 2 iso 0 dist 5.63005 10.5268 8.73993 4.01593 6.52773 7.20179 5.92411 7.64052 9.68677 5.37917 numMergedOcc 0
49 mol 119 unq 3 iso 0 dist 5.63005 10.5268 8.73993 13.1254 9.23858 9.89358 5.92411 7.64052 9.68677 15.7711 numMergedOcc 0
50 mol 122 unq 0 iso 0 dist 6.78949 7.54208 8.37808 4.21285 8.88537 5.0355 4.78332 6.00603 6.15636 6.29388 numMergedOcc 0
51 mol 122 unq 1 iso 0 dist 6.78949 7.54208 8.37808 6.93382 9.23819 7.39059 4.78332 6.00603 6.15636 9.83972 numMergedOcc 0
52 mol 122 unq 2 iso 0 dist 9.40018 11.0216 8.37808 9.33734 8.88537 5.0355 12.4857 6.00603 6.15636 6.29388 numMergedOcc 0
53 mol 122 unq 3 iso 0 dist 9.40018 11.0216 8.37808 4.81033 9.23819 7.39059 12.4857 6.00603 6.15636 9.83972 numMergedOcc 0
54 mol 143 unq 0 iso 0 dist 8.30654 11.3469 5.99315 11.6678 7.78652 6.48978 9.60065 7.36975 13.1926 12.207 numMergedOcc 0
55 mol 143 unq 1 iso 0 dist 8.30654 11.3469 5.99315 11.6678 7.78652 6.48978 4.68518 5.40637 7.39837 10.0079 numMergedOcc 0
56 mol 143 unq 2 iso 0 dist 8.30654 11.3469 5.99315 11.347 8.91301 5.20762 9.60065 7.36975 13.1926 14.7271 numMergedOcc 0
57 mol 143 unq 3 iso 0 dist 8.30654 11.3469 5.99315 11.347 8.91301 5.20762 4.68518 5.40637 7.39837 9.05366 numMergedOcc 0
58 mol 181 unq 0 iso 0 dist 9.84952 4.3158 7.81386 6.78739 5.94469 7.77758 7.19461 6.64173 6.8757 4.98436 numMergedOcc 0
59 mol 181 unq 1 iso 0 dist 9.84952 4.3158 7.81386 6.78739 5.94469 7.77758 9.77747 9.01624 5.71898 11.9796 numMergedOcc 0
60 mol 181 unq 2 iso 0 dist 9.84952 4.3158 7.81386 6.78739 5.94469 7.77758 10.0615 9.55105 5.83796 12.3589 numMergedOcc 0
61 mol 181 unq 3 iso 0 dist 9.84952 12.9554 7.63312 6.78739 5.94469 12.5387 7.19461 6.64173 10.6474 4.98436 numMergedOcc 0
62 mol 181 unq 4 iso 0 dist 9.84952 12.9554 7.63312 6.78739 5.94469 12.5387 9.77747 9.01624 5.93724 11.9796 numMergedOcc 0
63 mol 181 unq 5 iso 0 dist 9.84952 12.9554 7.63312 6.78739 5.94469 12.5387 10.0615 9.55105 5.12833 12.3589 numMergedOcc 0
64 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 3.99238 6.03688 8.15057 6.96644 6.52816 9.49403 5.28417 numMergedOcc 0
65 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 3.99238 6.03688 12.4957 6.96644 6.52816 13.514 5.28417 numMergedOcc 0
66 mol 205 unq 2 iso 0 dist 5.96555 5.87892 7.80463 3.99238 6.03688 6.09749 6.96644 6.52816 3.56269 5.28417 numMergedOcc 0
67 mol 259 unq 0 iso 0 dist 8.06771 6.64729 8.13497 5.61261 7.98231 8.41846 9.0675 9.46361 12.2293 4.10176 numMergedOcc 0
68 mol 259 unq 1 iso 0 dist 8.06771 9.79538 7.88519 5.61261 7.98231 8.81835 9.0675 9.46361 11.6988 4.10176 numMergedOcc 0
69 mol 259 unq 2 iso 0 dist 9.54857 15.3806 7.46176 8.74892 7.08526 8.81835 5.49348 5.85442 10.067 4.47425 numMergedOcc 0
70 mol 259 unq 3 iso 0 dist 9.54857 15.3806 7.46176 8.74892 7.08526 8.81835 5.13138 6.95511 11.6988 4.10176 numMergedOcc 0
71 mol 292 unq 0 iso 0 dist 9.20416 5.26243 8.2734 11.6878 7.07965 10.8848 8.88312 7.20674 7.8414 13.8094 numMergedOcc 0
72 mol 292 unq 1 iso 0 dist 9.20416 5.26243 8.2734 11.6878 7.07965 10.8848 12.3704 8.38121 14.179 13.8468 numMergedOcc 0
73 mol 292 unq 2 iso 0 dist 7.53641 5.58251 8.2734 8.46139 7.07965 10.8848 10.0594 7.20674 7.8414 13.8094 numMergedOcc 0
74 mol 292 unq 3 iso 0 dist 7.53641 5.58251 8.2734 8.46139 7.07965 10.8848 15.5666 8.38121 14.179 13.8468 numMergedOcc 0
